data_2mnj_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 2mnj _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 ' 5' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 1.5 m . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -119.57 143.1 32.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 120.829 0.347 . . . . 0.0 110.795 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.41 137.4 33.41 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.4 mm -105.41 121.05 47.49 Favored Pre-proline 0 C--N 1.319 -0.747 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.101 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.86 125.71 12.96 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.196 1.931 . . . . 0.0 111.956 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 p -103.31 127.98 56.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.551 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.446 HG11 HG13 ' A' ' 13' ' ' VAL . 44.2 t -95.04 125.17 47.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.816 178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.435 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 35.3 mt-10 -93.25 96.05 9.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.637 0.732 . . . . 0.0 110.428 178.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 5.0 m -107.27 177.49 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.208 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.09 -14.02 24.61 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -178.61 166.83 1.77 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.596 -1.183 . . . . 0.0 109.677 173.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 22' ' ' ARG . 1.1 mm? -73.73 149.6 88.21 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.532 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.03 168.18 21.35 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.432 2.088 . . . . 0.0 111.516 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.23 140.22 57.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -24.31 18.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.688 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -86.06 164.32 17.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.016 0.436 . . . . 0.0 111.087 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.59 95.49 5.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.645 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.486 ' HB2' HD21 ' A' ' 16' ' ' LEU . 33.4 ttt-85 . . . . . 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.0 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 . . . . . 0 N--CA 1.445 -0.724 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 83.5 m-85 -89.86 152.82 21.07 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -129.65 119.05 22.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 51.9 t -97.48 132.12 42.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.533 -175.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.416 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -125.88 132.91 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 176.187 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.7 ttt -118.14 139.34 51.4 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.505 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.492 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.3 tmtp? -144.9 132.73 21.19 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.309 -175.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.456 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -94.3 134.12 37.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.265 -176.55 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.492 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.9 m-85 -121.55 134.98 55.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.804 179.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -116.22 118.82 33.85 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.499 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.21 19.76 62.0 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.386 175.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -108.62 172.07 7.06 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 122.709 -0.289 . . . . 0.0 110.492 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.82 -20.37 63.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.343 0.592 . . . . 0.0 110.434 176.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.58 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -128.87 141.57 51.24 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.561 177.73 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.521 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -98.05 -21.45 16.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.229 0.537 . . . . 0.0 109.622 -176.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.535 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.09 132.83 29.02 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.235 -179.176 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.41 ' N ' HD12 ' B' ' 48' ' ' LEU . 31.9 ttp180 -114.71 121.23 42.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.4 mp -118.52 128.54 75.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.538 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.3 mm? -114.98 121.09 42.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.442 -177.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -125.31 104.25 13.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.8 pt-20 -107.06 153.36 22.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.982 0.42 . . . . 0.0 110.614 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.14 107.41 19.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.129 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -130.05 93.78 3.57 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.458 0.647 . . . . 0.0 110.346 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.791 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.505 -179.412 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 . . . . . 0 N--CA 1.448 -0.536 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 16.0 m -129.95 79.89 72.25 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-O 121.153 0.502 . . . . 0.0 109.778 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.437 ' C ' ' HG ' ' B' ' 67' ' ' SER . 63.9 Cg_endo -79.68 150.41 21.49 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 111.784 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.502 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 14.1 m -154.03 142.38 20.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.491 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.428 ' HH ' HG12 ' B' ' 91' ' ' VAL . 59.7 t80 -104.56 118.47 36.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.493 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.443 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.0 OUTLIER -100.05 115.27 29.35 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.748 177.119 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -64.25 -28.2 69.57 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.506 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.75 -46.63 70.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.407 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.504 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -112.46 2.44 16.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.568 -177.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . 0.419 HD22 ' NE ' ' B' ' 87' ' ' ARG . 2.1 p-10 48.37 45.56 20.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.38 1.072 . . . . 0.0 111.822 -175.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.504 HG13 ' O ' ' B' ' 72' ' ' GLU . 66.9 mt -124.07 137.95 55.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.152 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -102.9 104.21 14.43 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.502 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.5 p90 -93.07 142.1 27.67 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.84 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.1 mm -88.24 -54.02 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 -177.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 41.3 m-20 -153.25 176.91 11.43 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.3 40.63 1.75 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.56 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . 0.645 ' HD3' ' O ' ' B' ' 80' ' ' LYS . 0.0 OUTLIER -131.23 -36.53 1.3 Allowed 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.474 ' HG ' ' HG3' ' B' ' 80' ' ' LYS . 0.2 OUTLIER -154.53 153.53 31.61 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.441 0.638 . . . . 0.0 111.704 175.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 21.2 p -130.47 148.99 52.34 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.274 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mm -107.84 102.53 45.79 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 120.819 0.342 . . . . 0.0 110.178 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.85 135.13 17.2 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.208 1.939 . . . . 0.0 112.117 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -97.59 141.09 22.47 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.559 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -64.76 139.62 63.77 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.986 1.791 . . . . 0.0 110.761 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.419 ' NE ' HD22 ' B' ' 73' ' ' ASN . 9.6 mpt_? -70.82 -0.99 10.2 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.789 -174.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -79.28 -16.79 55.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.534 0.683 . . . . 0.0 109.714 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -110.04 137.1 43.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.6 p -92.32 112.37 25.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . 0.428 HG12 ' HH ' ' B' ' 68' ' ' TYR . 2.5 p -121.38 139.32 48.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.306 0.574 . . . . 0.0 111.218 -174.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.56 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.5 164.69 29.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.011 -178.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.83 -23.53 63.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.058 0.456 . . . . 0.0 111.577 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.06 -16.48 43.63 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.279 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.56 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.7 t70 -102.51 -24.27 13.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.683 0.754 . . . . 0.0 109.563 -176.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . 0.419 HG23 HG13 ' B' ' 98' ' ' ILE . 81.3 mt -72.78 115.55 13.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.306 177.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -109.47 106.49 16.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.718 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.419 HG13 HG23 ' B' ' 96' ' ' ILE . 57.2 mt -110.99 121.14 63.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.447 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -134.54 124.43 25.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.367 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.435 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 22.5 t-80 -105.5 113.09 26.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.715 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.58 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 3.0 mp -89.37 118.39 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 175.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 62.8 mtp85 -81.76 -23.71 36.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.866 -177.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -57.94 -43.33 86.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.14 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.486 ' H ' HG23 ' B' ' 101' ' ' ILE . 11.0 pt-20 -110.0 0.98 18.72 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.456 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 58.27 38.49 26.08 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.63 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.426 HG21 ' HB3' ' B' ' 53' ' ' GLU . 29.1 m -117.73 137.92 52.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 120.921 0.391 . . . . 0.0 110.674 -176.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.25 114.35 28.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.875 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.538 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.2 m-85 -93.48 125.44 38.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.377 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 44.0 mm -115.04 121.95 68.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.109 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.44 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.0 m-85 -121.8 127.83 51.02 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.58 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.3 mt . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.783 -0.627 . . . . 0.0 109.767 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.0 p . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.3 m -122.51 141.01 44.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.748 -176.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.412 ' HA ' ' CB ' ' B' ' 67' ' ' SER . 0.3 OUTLIER -88.19 138.03 31.81 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.061 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.435 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.0 mm -107.59 120.92 45.87 Favored Pre-proline 0 C--N 1.317 -0.827 0 C-N-CA 120.634 -0.427 . . . . 0.0 109.887 -176.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.12 130.63 21.84 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.503 2.135 . . . . 0.0 112.469 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.9 t -89.67 131.84 35.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.645 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.435 ' HB ' ' CD2' ' B' ' 99' ' ' PHE . 47.6 t -97.48 111.22 26.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 172.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.5 mt-10 -92.64 107.19 19.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.629 0.728 . . . . 0.0 110.789 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.4 m -135.43 -174.33 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.299 -177.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.512 ' OD1' ' HB2' ' B' ' 103' ' ' LYS . 24.5 m-20 -105.61 -10.07 17.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.887 0.375 . . . . 0.0 110.547 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -165.19 156.28 14.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.687 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.432 HD23 ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -84.77 156.2 61.45 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.702 0.287 . . . . 0.0 110.722 -179.1 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -54.88 170.55 0.61 Allowed 'Trans proline' 0 C--O 1.238 0.501 0 C-N-CA 123.464 2.776 . . . . 0.0 113.161 172.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.24 142.22 58.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.397 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.56 -9.7 66.7 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.24 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -88.11 147.1 25.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.274 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -101.38 102.89 13.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.434 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.432 ' HD2' HD23 ' A' ' 16' ' ' LEU . 14.5 ttt180 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.049 -172.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.508 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 34.1 tt0 . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 121.381 0.61 . . . . 0.0 109.766 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.6 m-85 -84.28 154.48 22.95 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.529 176.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -123.59 113.7 19.04 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -95.45 131.43 42.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.984 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.55 142.95 51.24 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.523 ' HG2' HD13 ' B' ' 48' ' ' LEU . 1.5 ttt -124.26 140.64 52.77 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.015 -0.274 . . . . 0.0 110.582 -176.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.465 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.9 tmtp? -145.3 133.82 22.0 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.704 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.465 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.92 137.49 34.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.713 179.366 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -117.54 150.67 38.58 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -125.27 111.17 14.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.958 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.59 54.52 6.62 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.584 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.81 171.45 14.48 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 174.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.78 66.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.687 0.756 . . . . 0.0 110.206 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.661 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -124.84 135.56 53.03 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.923 -178.756 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.523 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.5 mppt? -96.07 -23.53 16.75 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.523 HD13 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -136.66 130.3 31.97 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.735 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -118.63 123.46 45.04 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.836 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.512 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.3 mp -120.04 130.85 73.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.482 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.73 119.95 38.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -123.74 103.48 12.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -108.86 153.7 23.15 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.693 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . 0.4 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -100.52 114.43 28.05 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.501 -178.866 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.567 ' O ' ' HD3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -137.61 90.95 2.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.664 0.745 . . . . 0.0 111.318 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.508 ' HB3' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.32 -0.711 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.63 177.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 . . . . . 0 CA--C 1.517 -0.316 0 CA-C-O 120.727 0.298 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 11.5 t -135.61 79.86 46.08 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.67 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.411 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 66.2 Cg_endo -87.9 160.43 7.47 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.068 2.512 . . . . 0.0 113.168 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.412 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 38.8 p -161.96 144.44 11.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.731 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -103.47 119.58 39.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.787 -177.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -100.58 116.06 31.63 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.503 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -66.98 -24.91 66.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.891 -176.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.01 -43.26 86.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.708 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.462 ' O ' HG13 ' B' ' 74' ' ' ILE . 10.3 mt-10 -112.45 4.76 17.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 48.24 43.14 18.67 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 124.524 1.14 . . . . 0.0 111.067 -176.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.462 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.5 mt -119.25 134.67 62.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.269 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -102.92 103.34 13.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 176.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -88.8 144.91 25.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -178.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . 0.411 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 42.5 mm -98.51 -57.45 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.155 0.502 . . . . 0.0 110.927 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.4 ' C ' ' H ' ' B' ' 80' ' ' LYS . 16.2 m-20 -147.07 179.06 7.89 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.22 4.76 10.72 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.286 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' B' ' 78' ' ' ASN . 72.2 mmtt -93.86 -45.1 7.79 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.487 ' O ' HD11 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -151.8 153.23 33.85 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.557 0.694 . . . . 0.0 112.452 -177.464 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 10.6 p -126.47 147.43 49.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.891 176.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 52.1 mm -106.83 109.12 62.93 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.936 0.398 . . . . 0.0 110.751 -177.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.454 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.9 Cg_endo -81.49 137.15 10.18 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.262 1.974 . . . . 0.0 112.024 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.91 150.18 36.83 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.949 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.22 142.15 85.26 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.537 2.158 . . . . 0.0 111.552 176.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -79.19 -2.83 42.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.069 -176.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.33 2.33 56.7 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.786 0.327 . . . . 0.0 111.083 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 58.1 mt -121.95 138.28 52.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.506 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.26 122.91 38.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 52.3 t -126.14 130.16 72.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.207 0.527 . . . . 0.0 111.299 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.597 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.31 161.44 37.89 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.725 177.427 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.45 -12.6 54.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.201 -175.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.62 -9.23 47.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.213 0.53 . . . . 0.0 110.882 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.597 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 12.7 t70 -111.75 -24.82 9.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.673 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.3 mt -73.08 115.06 13.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.949 176.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.437 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.9 mmmm -111.35 101.92 10.35 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.949 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.435 HD12 ' HB ' ' A' ' 8' ' ' ILE . 32.8 mt -101.85 122.6 54.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 111.343 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . 0.435 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 70.7 m-85 -133.21 118.13 18.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.252 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.475 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 20.2 t-80 -100.4 107.78 19.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.821 0.343 . . . . 0.0 110.495 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.618 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 49.8 mt -86.85 102.56 12.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.18 0.514 . . . . 0.0 110.021 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -17.34 63.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.658 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . 0.512 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 30.8 tttm -67.19 -48.91 66.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.998 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.487 ' H ' HG23 ' B' ' 101' ' ' ILE . 9.4 mm-40 -101.32 4.93 42.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.159 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? 55.28 37.08 28.36 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.652 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 40.0 m -125.25 130.6 52.39 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.066 -174.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.54 117.69 33.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.629 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.587 ' CE1' HD12 ' B' ' 101' ' ' ILE . 10.1 m-85 -95.99 124.39 39.98 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.113 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.512 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.1 mm -114.81 115.92 50.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.869 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.487 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.3 m-85 -116.4 125.11 51.58 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 176.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.661 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 58.7 mt . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.94 -0.552 . . . . 0.0 109.741 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.7 m -130.81 145.89 34.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.941 0.4 . . . . 0.0 110.891 -177.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 136.15 33.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.899 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.416 ' HB ' HD11 ' B' ' 98' ' ' ILE . 6.5 mm -105.19 121.08 47.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.309 -178.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.03 130.53 15.58 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.433 2.089 . . . . 0.0 112.26 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 46.4 t -86.95 133.3 30.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.576 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.47 HG11 HG12 ' A' ' 13' ' ' VAL . 98.9 t -98.01 119.94 46.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 173.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -93.18 111.99 23.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.566 0.698 . . . . 0.0 110.697 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.47 HG12 HG11 ' A' ' 11' ' ' VAL . 4.8 m -129.6 170.46 18.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.535 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -91.61 -20.24 21.86 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -168.76 155.9 7.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.12 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.422 HD23 ' HD2' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -78.7 149.32 74.3 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -67.56 172.23 10.71 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.328 2.019 . . . . 0.0 111.44 177.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.74 135.86 57.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.163 0.506 . . . . 0.0 111.439 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.0 -17.26 27.31 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.793 -175.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -94.06 146.73 23.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.939 0.4 . . . . 0.0 111.074 178.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -101.27 95.22 6.38 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.103 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.422 ' HD2' HD23 ' A' ' 16' ' ' LEU . 18.3 ttt180 . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.841 -178.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.446 -0.636 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.536 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 92.5 m-85 -90.47 142.03 28.15 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.692 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.428 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 35.2 tt0 -112.4 107.15 15.84 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.6 p -94.91 127.26 47.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.261 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.428 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -124.26 121.44 35.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.514 ' HG2' HD13 ' B' ' 48' ' ' LEU . 2.5 ttt -107.65 139.11 42.7 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 -175.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.532 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 8.4 tmtm? -144.54 134.87 24.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.853 0.358 . . . . 0.0 110.515 -174.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.5 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -94.76 134.17 37.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -178.808 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.532 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 34.5 m-85 -119.15 139.4 51.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.985 0.422 . . . . 0.0 111.128 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -130.41 116.29 18.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.597 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 90.82 32.27 9.29 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.95 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.79 170.85 13.35 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.43 64.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.401 0.619 . . . . 0.0 110.448 177.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.537 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.3 p90 -126.97 147.58 50.11 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.795 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.521 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -104.57 -18.62 14.27 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.24 0.543 . . . . 0.0 109.742 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.536 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.83 133.34 31.9 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.398 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -119.77 131.12 55.26 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.536 ' CD1' HD12 ' B' ' 48' ' ' LEU . 1.9 mp -128.19 128.45 68.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.568 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.9 mm? -111.55 119.92 40.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.1 mp -126.88 104.07 12.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.536 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -111.43 153.76 25.65 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.942 0.401 . . . . 0.0 110.55 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.06 100.32 11.46 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.488 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -129.28 93.5 3.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.6 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.669 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.106 176.249 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 . . . . . 0 N--CA 1.453 -0.318 0 CA-C-O 120.655 0.264 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.3 m -133.02 79.21 63.42 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 176.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.466 ' C ' ' HG ' ' B' ' 67' ' ' SER . 89.7 Cg_endo -83.29 153.38 14.07 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.78 2.32 . . . . 0.0 112.436 -178.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.466 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 14.2 m -156.65 145.95 20.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.213 -178.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.422 ' HB2' HD22 ' B' ' 75' ' ' LEU . 49.8 t80 -108.34 124.42 50.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.599 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -105.28 116.71 32.41 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.646 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -66.7 -25.89 66.76 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.687 -176.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.8 -50.99 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.547 -178.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.531 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.9 mt-10 -112.68 7.56 18.71 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.486 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 50.66 42.73 27.51 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 124.268 0.98 . . . . 0.0 111.429 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.531 HG13 ' O ' ' B' ' 72' ' ' GLU . 68.1 mt -117.75 138.07 49.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.457 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.434 HD13 ' C ' ' B' ' 75' ' ' LEU . 3.4 tm? -105.03 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.49 140.17 29.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.7 mm -92.85 -57.06 4.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.958 -176.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.452 ' C ' ' H ' ' B' ' 80' ' ' LYS . 57.8 m-20 -151.95 -177.81 6.37 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -178.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.19 20.93 2.94 Favored Glycine 0 C--O 1.225 -0.409 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.964 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . 0.452 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.7 mmtt -110.62 -38.36 5.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.473 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.8 OUTLIER -160.47 153.36 21.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.876 178.052 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.2 t -127.92 150.37 49.91 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.584 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mm -114.81 100.81 53.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.952 0.405 . . . . 0.0 111.045 -175.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.442 ' HA ' HG12 ' B' ' 74' ' ' ILE . 21.4 Cg_exo -67.92 136.55 38.67 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.712 2.275 . . . . 0.0 112.33 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 63.6 mt -103.65 153.82 38.37 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.092 -178.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.33 138.69 30.63 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.125 1.883 . . . . 0.0 111.787 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.408 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 1.8 mmt180 -74.9 2.18 10.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.804 -177.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -86.91 -18.41 30.88 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.415 0.626 . . . . 0.0 110.053 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 66.7 mt -104.38 134.01 46.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.303 -176.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 48.3 t -82.46 111.57 19.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.85 130.93 73.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.324 0.583 . . . . 0.0 111.461 -172.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.553 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.82 163.36 33.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.358 175.137 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.21 -19.01 64.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.913 0.387 . . . . 0.0 111.799 -177.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.3 -13.3 55.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.961 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.553 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 23.3 t0 -109.04 -20.69 12.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.573 0.701 . . . . 0.0 109.881 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . 0.405 HG22 HG13 ' B' ' 98' ' ' ILE . 80.3 mt -76.73 116.27 19.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.786 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.456 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.5 mmmt -109.62 104.07 13.03 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.254 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.416 HD11 ' HB ' ' A' ' 8' ' ' ILE . 49.1 mt -107.82 121.38 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -130.71 121.12 24.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.257 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -104.5 114.76 29.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.898 0.38 . . . . 0.0 110.597 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.459 HG23 ' H ' ' B' ' 104' ' ' GLU . 58.7 mt -90.96 100.55 11.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -69.69 -24.48 63.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.148 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -59.23 -47.92 83.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.321 0.581 . . . . 0.0 110.494 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.459 ' H ' HG23 ' B' ' 101' ' ' ILE . 13.7 mm-40 -100.88 0.79 39.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.819 -175.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 57.1 33.5 23.42 Favored 'General case' 0 N--CA 1.46 0.072 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.66 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.413 ' CG2' HD13 ' B' ' 51' ' ' LEU . 46.1 m -119.62 130.13 54.95 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -174.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.27 121.27 41.94 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.03 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.568 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.7 m-85 -98.97 126.79 44.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.155 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.448 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.3 mm -115.36 121.4 67.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.899 175.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.456 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 82.2 m-85 -122.55 124.32 43.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.537 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.819 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.901 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.3 p . . . . . 0 N--CA 1.45 -0.46 0 CA-C-O 120.92 0.39 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -125.84 142.63 41.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.324 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.496 ' HA ' ' CB ' ' B' ' 67' ' ' SER . 0.5 OUTLIER -91.5 140.05 30.12 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.352 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.5 mm -110.35 123.52 35.67 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 -176.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -71.39 125.51 11.35 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.077 1.851 . . . . 0.0 111.979 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.406 HG21 HG21 ' B' ' 98' ' ' ILE . 1.9 p -97.65 119.96 46.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.482 HG11 HG12 ' A' ' 13' ' ' VAL . 61.5 t -91.29 117.13 33.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -84.72 111.91 20.01 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.325 0.583 . . . . 0.0 110.271 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.482 HG12 HG11 ' A' ' 11' ' ' VAL . 3.3 m -124.55 -174.77 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.58 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -93.73 -26.77 16.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -171.14 167.19 7.16 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.344 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 22' ' ' ARG . 2.3 mm? -71.04 143.49 88.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.636 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.92 174.48 11.15 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.928 2.419 . . . . 0.0 112.259 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.85 139.77 12.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.459 178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.16 -9.42 57.85 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.429 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -102.86 167.52 9.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.991 0.424 . . . . 0.0 111.953 -179.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -127.53 98.92 5.39 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.575 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.432 ' HB2' HD22 ' A' ' 16' ' ' LEU . 26.5 ttp85 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.4 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.42 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.8 tt0 . . . . . 0 N--CA 1.447 -0.586 0 CA-C-O 121.255 0.55 . . . . 0.0 109.573 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 79.1 m-85 -85.76 145.16 27.37 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.029 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -123.47 112.75 17.88 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.618 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -100.83 131.39 48.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.694 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.443 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -120.81 150.51 40.91 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.536 ' HG2' HD12 ' B' ' 48' ' ' LEU . 2.3 ttt -135.63 134.49 39.31 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -176.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 10.2 tmtt? -142.83 132.55 23.94 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.996 -0.281 . . . . 0.0 110.527 -172.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.472 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.5 OUTLIER -95.01 133.01 39.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.132 0.492 . . . . 0.0 111.006 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -111.85 140.33 46.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.012 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -118.4 121.97 41.64 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.275 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.01 46.54 43.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.638 -179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.09 170.94 14.26 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.49 -14.41 62.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.106 0.479 . . . . 0.0 110.768 178.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.485 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -134.82 137.69 43.56 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.611 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.542 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -96.32 -23.2 16.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.519 . . . . 0.0 109.841 -173.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.552 HD11 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.35 133.51 34.96 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.448 -176.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -119.31 122.46 41.92 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.552 ' CD1' HD11 ' B' ' 48' ' ' LEU . 2.4 mp -117.4 131.56 69.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.618 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 3.4 mm? -117.52 118.03 31.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 -176.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -122.71 103.74 13.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.9 pt-20 -110.42 153.41 25.03 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.371 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -102.12 108.82 20.36 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.365 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -134.01 92.84 3.01 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.651 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.42 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.663 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 . . . . . 0 N--CA 1.451 -0.383 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 50.6 m -138.3 79.97 29.43 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.454 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 71.9 Cg_endo -81.38 153.31 18.25 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.634 2.223 . . . . 0.0 113.102 -178.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.496 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 99.2 p -159.09 150.38 20.27 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.206 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.449 ' HB2' HD23 ' B' ' 75' ' ' LEU . 45.0 t80 -108.83 128.01 54.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.597 -177.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.613 ' O ' ' HA ' ' B' ' 73' ' ' ASN . 0.1 OUTLIER -108.2 128.11 54.43 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 176.512 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -75.1 -25.41 58.51 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.297 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.79 -51.45 69.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.816 -174.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.56 ' O ' HD11 ' B' ' 74' ' ' ILE . 11.0 mm-40 -103.62 -10.6 18.28 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . 0.613 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 1.8 p-10 59.95 45.34 12.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.499 1.143 . . . . 0.0 110.183 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.56 HD11 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.7 143.8 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 113.914 -1.494 . . . . 0.0 109.099 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.449 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.2 tm? -110.27 97.83 7.21 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.454 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -87.42 143.69 27.11 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.037 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 45.3 mm -95.84 -56.08 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.417 -171.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -160.46 24.0 0.15 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -174.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.1 -22.94 5.58 Favored Glycine 0 C--N 1.322 -0.246 0 C-N-CA 120.122 -1.037 . . . . 0.0 112.774 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -79.48 -28.61 41.48 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.475 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.7 OUTLIER -162.45 153.54 17.63 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.325 175.031 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' SER . . . . . 0.436 ' O ' ' HD3' ' B' ' 84' ' ' PRO . 63.5 p -124.3 150.61 45.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.571 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -106.93 100.14 30.15 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.809 0.338 . . . . 0.0 110.328 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.468 ' HA ' HD12 ' B' ' 74' ' ' ILE . 25.9 Cg_exo -65.91 131.5 27.44 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.686 2.257 . . . . 0.0 112.005 177.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.448 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 87.6 mt -101.72 151.37 37.89 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.261 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.35 143.24 31.15 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.647 2.231 . . . . 0.0 112.206 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.409 ' HD3' ' N ' ' B' ' 87' ' ' ARG . 0.0 OUTLIER -80.28 -3.38 49.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.5 -178.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -82.44 -9.62 59.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 59.9 mt -118.88 136.49 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.429 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.7 p -87.55 115.11 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 48.1 t -123.06 136.18 60.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.095 0.474 . . . . 0.0 111.248 -174.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.725 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.48 164.54 29.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.965 178.396 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.16 -23.83 65.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.652 -176.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.67 -12.03 56.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.769 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.725 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 14.4 t0 -104.06 -24.64 13.19 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.787 0.803 . . . . 0.0 109.244 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.36 117.69 24.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.219 -179.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.417 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.6 mmmt -112.09 108.0 17.12 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.985 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.406 HG21 HG21 ' A' ' 10' ' ' VAL . 47.2 mt -111.63 118.26 57.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -132.45 121.83 24.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.269 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 38.4 t-80 -107.02 112.09 24.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.958 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.53 HG21 ' H ' ' B' ' 104' ' ' GLU . 3.9 mp -85.18 108.35 16.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -76.12 -24.9 54.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.119 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.5 -46.5 89.73 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.53 ' H ' HG21 ' B' ' 101' ' ' ILE . 14.6 mt-10 -92.12 -2.2 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.28 0.562 . . . . 0.0 110.096 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 47.6 mtp180 54.23 38.91 30.21 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.287 -177.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.418 HG22 ' HB3' ' B' ' 53' ' ' GLU . 32.8 m -123.34 131.95 53.83 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.82 -172.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.73 114.89 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.454 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.607 ' CE2' HD11 ' B' ' 51' ' ' LEU . 48.6 m-85 -93.67 120.87 34.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.05 177.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.483 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.4 mm -110.88 123.85 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.974 177.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 84.7 m-85 -122.69 129.12 51.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 63.8 mt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.738 -0.649 . . . . 0.0 109.618 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 27.2 p . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 121.343 0.592 . . . . 0.0 112.316 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.2 m -128.75 142.54 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.549 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.11 137.81 32.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 -177.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 mm -109.04 118.66 50.84 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.71 123.89 10.19 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.122 1.881 . . . . 0.0 111.849 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 p -96.14 127.92 47.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.773 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.431 HG11 HG13 ' A' ' 13' ' ' VAL . 58.6 t -92.12 128.21 43.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.71 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 39.5 mt-10 -97.49 109.11 21.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.328 0.585 . . . . 0.0 110.322 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.535 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.5 m -131.76 176.14 9.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.553 -177.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -101.2 -9.73 21.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.652 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -164.3 156.38 16.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.926 176.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.457 HD22 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -83.78 153.7 64.37 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.12 177.336 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -51.89 167.07 0.5 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.38 2.72 . . . . 0.0 113.318 173.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -72.3 130.54 41.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.99 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.6 29.91 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -173.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.28 153.05 18.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.071 0.462 . . . . 0.0 110.762 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -110.25 97.75 7.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.872 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.552 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 53.1 ttp85 . . . . . 0 C--N 1.324 -0.505 0 CA-C-O 121.071 0.462 . . . . 0.0 111.683 -176.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 34.0 tt0 . . . . . 0 N--CA 1.444 -0.73 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 90.4 m-85 -86.89 152.66 22.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.478 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -120.53 110.58 16.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.009 176.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 57.3 t -92.96 124.21 45.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.397 -178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.465 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -121.57 137.92 54.53 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.107 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.463 ' HG2' HD13 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -120.43 139.83 52.26 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 -175.748 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.509 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.2 135.72 21.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.678 0.275 . . . . 0.0 110.295 -176.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.509 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -97.66 135.48 39.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 -178.128 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -118.26 147.53 43.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.458 177.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -133.72 119.8 19.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.065 0.459 . . . . 0.0 110.494 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.85 26.97 52.19 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.109 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.79 171.25 8.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.91 -13.98 60.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.133 0.492 . . . . 0.0 110.98 179.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.54 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -133.09 146.33 51.55 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 176.537 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.531 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -100.95 -22.26 14.84 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.23 0.538 . . . . 0.0 109.726 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.495 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.94 135.42 36.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.225 -178.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -120.46 129.16 53.75 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.525 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -123.16 131.65 72.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.608 HD13 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -115.14 117.13 29.67 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.2 102.9 13.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.461 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.9 pt-20 -109.05 153.32 23.81 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.896 0.379 . . . . 0.0 110.168 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.62 113.85 26.07 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.91 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.456 ' HB2' ' HZ1' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.02 93.23 3.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.368 0.604 . . . . 0.0 110.562 178.066 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.417 ' HB3' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.757 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.0 t -131.96 78.17 70.22 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 81.6 Cg_endo -81.1 151.39 18.2 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.766 2.31 . . . . 0.0 113.621 -178.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.42 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 15.2 m -156.08 150.53 25.76 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.035 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.478 ' CZ ' HG11 ' B' ' 91' ' ' VAL . 40.1 t80 -108.02 124.35 50.04 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.714 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.526 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.8 p-10 -103.3 112.36 25.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.109 0.481 . . . . 0.0 110.55 176.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.61 -33.01 73.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.575 -177.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.64 -48.92 68.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.623 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.559 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.4 mt-10 -110.54 5.93 21.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.411 -176.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 48.51 43.16 19.82 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.397 1.06 . . . . 0.0 111.587 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.559 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.2 mt -118.15 143.32 29.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.555 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.406 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -109.32 101.81 10.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.54 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -88.6 142.81 27.39 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.826 -178.086 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 47.5 mm -96.05 -48.92 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.576 -177.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -165.71 -168.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.584 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.75 -4.94 59.7 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.007 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -86.5 -40.12 15.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.493 ' O ' HD11 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -161.6 154.02 20.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.602 0.715 . . . . 0.0 112.675 -179.762 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.9 p -123.58 148.25 46.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.415 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.6 mm -105.23 105.21 51.06 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 120.621 0.248 . . . . 0.0 110.536 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.493 ' HA ' HG12 ' B' ' 74' ' ' ILE . 59.1 Cg_endo -74.85 131.58 14.64 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.138 1.892 . . . . 0.0 111.77 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 65.9 mt -99.79 154.08 37.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.031 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.43 139.91 46.57 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.335 2.023 . . . . 0.0 112.061 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -77.59 -6.85 55.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 -177.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -84.76 -12.43 53.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.302 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.6 mt -113.96 133.83 58.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.986 -176.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.5 127.78 39.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.481 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . 0.478 HG11 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -137.35 138.91 44.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.259 0.552 . . . . 0.0 111.524 -174.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.536 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.33 166.38 24.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.044 178.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.09 -22.57 64.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.147 0.499 . . . . 0.0 111.572 -177.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.81 -9.75 55.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.114 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.536 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 31.0 t70 -107.08 -23.76 12.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.755 0.788 . . . . 0.0 109.688 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.9 mt -74.74 116.69 17.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.443 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.411 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.4 mmmm -111.34 105.36 13.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.894 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 56.3 mt -110.17 120.55 61.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.994 -178.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.23 119.2 21.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.422 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.4 t-80 -97.14 108.03 20.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.675 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.535 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 46.8 mt -86.7 98.01 6.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 172.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -72.99 -20.59 60.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -58.15 -49.09 78.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.472 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.456 ' H ' HG23 ' B' ' 101' ' ' ILE . 8.4 mm-40 -99.88 1.14 42.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.538 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 55.02 36.13 26.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.269 -175.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.44 HG22 ' HB3' ' B' ' 53' ' ' GLU . 22.7 m -116.73 126.4 53.1 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.35 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 54.3 tp -101.28 121.72 42.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.662 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.608 ' CE2' HD13 ' B' ' 51' ' ' LEU . 21.2 m-85 -101.97 128.29 48.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.384 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.525 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.6 mm -116.3 122.0 68.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.66 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.473 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 86.0 m-85 -122.44 126.35 47.74 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.54 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--N 1.319 -0.752 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.715 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.459 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 28.5 p . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.3 m -124.22 140.73 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.068 0.461 . . . . 0.0 110.642 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 135.1 35.03 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.157 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.4 mm -112.07 114.18 51.47 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -71.5 135.81 27.19 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 121.869 1.712 . . . . 0.0 111.08 175.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.4 p -100.41 128.59 52.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.748 -177.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.421 HG11 HG12 ' A' ' 13' ' ' VAL . 47.6 t -87.26 112.68 23.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.766 179.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.435 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.7 mt-10 -92.13 106.76 18.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.444 0.64 . . . . 0.0 110.223 179.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.421 HG12 HG11 ' A' ' 11' ' ' VAL . 2.2 m -129.21 -172.57 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.084 -175.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -96.87 -30.22 13.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.143 0.497 . . . . 0.0 109.661 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -149.66 166.05 30.51 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.233 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.474 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.8 mm? -80.05 141.47 54.5 Favored Pre-proline 0 C--N 1.316 -0.874 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.198 173.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.71 166.47 0.23 Allowed 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 123.485 2.79 . . . . 0.0 113.029 172.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -68.56 132.34 46.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.578 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.1 -2.17 29.91 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.638 -174.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -102.46 175.18 5.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.996 0.427 . . . . 0.0 111.142 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.59 112.33 12.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.707 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.474 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.5 ttp85 . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 178.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 . . . . . 0 N--CA 1.443 -0.796 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.409 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 96.1 m-85 -90.5 154.92 19.27 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.372 -178.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -120.0 108.9 14.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.068 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 92.1 t -91.11 129.36 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.008 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.428 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -127.07 142.75 51.45 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 176.791 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.491 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.3 ttt -123.97 141.21 52.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.637 -175.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.453 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.9 tmtt? -140.92 133.47 28.57 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.562 -176.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.453 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 9.2 mpt_? -99.34 138.73 36.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.995 0.426 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -118.77 167.32 11.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.448 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.31 105.23 4.02 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.013 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.84 46.96 6.9 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.891 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.98 172.19 12.96 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 -25.27 64.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.554 0.692 . . . . 0.0 110.492 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.542 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -131.8 141.95 49.6 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.684 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.518 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.05 -21.42 15.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.266 0.555 . . . . 0.0 109.679 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.491 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -139.66 135.29 33.09 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.781 -178.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -124.51 133.6 53.28 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.48 ' CD1' HD13 ' B' ' 48' ' ' LEU . 2.4 mp -125.45 132.37 71.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.465 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.4 mm? -113.55 121.99 45.89 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.3 103.13 11.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 177.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 14.0 pt-20 -114.99 153.41 30.67 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.106 0.479 . . . . 0.0 110.305 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -95.94 110.2 22.45 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.423 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -130.04 94.11 3.64 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.868 0.842 . . . . 0.0 110.536 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.084 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.515 179.437 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -136.92 79.64 38.34 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-O 121.096 0.474 . . . . 0.0 109.782 175.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -80.03 158.38 23.83 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.982 2.455 . . . . 0.0 113.486 -178.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 90.8 p -158.56 147.89 19.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.074 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.417 ' HB2' HD23 ' B' ' 75' ' ' LEU . 53.8 t80 -106.95 117.97 35.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.196 0.522 . . . . 0.0 110.847 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.5 p-10 -100.02 110.18 22.5 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.526 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -60.52 -33.58 72.85 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.66 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -51.79 -44.14 63.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.719 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.449 ' O ' HG13 ' B' ' 74' ' ' ILE . 4.1 mm-40 -111.56 4.0 18.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.46 44.9 17.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.422 -176.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.476 HG12 ' HA ' ' B' ' 84' ' ' PRO . 55.6 mt -121.74 135.05 63.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.163 -178.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.417 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -100.84 100.85 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.83 144.63 28.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -177.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.8 mm -98.41 -59.57 3.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.299 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -144.88 -178.04 5.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.419 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.98 3.61 27.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.749 176.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -90.21 -40.56 12.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.538 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.4 pp -160.22 153.29 21.68 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.624 -0.717 . . . . 0.0 112.224 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.9 p -121.07 147.56 45.36 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.65 174.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.0 mm -102.71 103.99 36.02 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.852 0.358 . . . . 0.0 110.344 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.476 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.3 Cg_endo -81.88 130.38 6.62 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.281 1.988 . . . . 0.0 112.599 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -96.86 147.2 32.57 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.955 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.36 140.65 64.77 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.199 1.932 . . . . 0.0 111.343 175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.14 -5.74 41.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.429 -175.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -81.5 -11.57 59.15 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.311 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 58.8 mt -114.84 136.64 50.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.902 -176.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.1 p -84.51 113.41 23.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.215 0.531 . . . . 0.0 109.971 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 62.1 t -120.49 130.72 74.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-O 121.122 0.487 . . . . 0.0 111.128 -175.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.519 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.43 164.43 30.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.912 177.962 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.22 -18.01 63.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.871 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.4 -14.82 48.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.831 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.519 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 20.4 t70 -108.67 -23.98 11.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.837 -175.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . 0.431 HG21 HG13 ' B' ' 98' ' ' ILE . 80.5 mt -73.45 115.33 14.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.18 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -110.09 98.82 8.01 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.575 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.431 HG13 HG21 ' B' ' 96' ' ' ILE . 39.2 mt -99.84 116.72 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.005 0.431 . . . . 0.0 110.766 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -130.66 121.34 25.38 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.095 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.435 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 75.6 t60 -109.54 125.29 52.35 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.047 0.451 . . . . 0.0 110.882 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.477 HD11 ' CE1' ' B' ' 108' ' ' TYR . 85.4 mt -104.12 113.02 39.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.973 177.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.51 -23.38 61.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.709 0.29 . . . . 0.0 110.573 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.467 ' H ' HG21 ' B' ' 101' ' ' ILE . 42.7 mt-10 -95.23 0.67 54.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.135 0.493 . . . . 0.0 109.985 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 51.71 37.29 19.79 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.207 -173.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 62.4 m -121.52 133.98 55.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.535 -173.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.33 118.16 36.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.964 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.493 ' HB3' ' CE1' ' B' ' 110' ' ' TYR . 29.8 m-85 -98.12 119.05 36.09 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.9 179.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.3 mm -108.99 123.0 64.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.843 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.493 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 67.7 m-85 -122.53 126.64 48.21 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.542 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.776 -0.631 . . . . 0.0 109.775 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 13.4 p . . . . . 0 N--CA 1.454 -0.259 0 CA-C-O 120.809 0.338 . . . . 0.0 110.589 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -114.79 140.86 33.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.203 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -86.11 139.11 31.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.098 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.44 ' HB ' HD13 ' B' ' 98' ' ' ILE . 4.0 mm -111.36 117.2 49.83 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.362 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -71.24 129.68 16.4 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.321 2.014 . . . . 0.0 112.428 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.07 137.07 21.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.6 t -101.15 112.95 35.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.539 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.0 mt-10 -94.98 107.88 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.418 0.628 . . . . 0.0 110.754 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.84 -173.27 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.631 -175.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.47 -33.57 36.57 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -175.46 175.78 2.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.741 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.44 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.9 mm? -78.17 140.66 61.6 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-O 120.772 0.32 . . . . 0.0 110.844 -177.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.97 173.65 9.95 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.81 2.34 . . . . 0.0 111.738 174.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -56.82 139.4 51.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.014 0.435 . . . . 0.0 110.952 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.04 -22.48 23.14 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.647 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.4 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . 66.7 m-85 -93.7 166.55 12.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.441 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -124.9 99.49 6.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.386 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.52 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 57.9 ttp85 . . . . . 0 C--N 1.321 -0.66 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.681 -178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 . . . . . 0 N--CA 1.45 -0.431 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.422 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 68.0 m-85 -87.19 153.88 21.16 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.417 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -132.87 116.59 16.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.543 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.7 p -102.27 132.3 48.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.01 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.61 151.35 44.94 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.545 ' HG2' HD13 ' B' ' 48' ' ' LEU . 1.0 OUTLIER -128.55 137.46 51.75 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -177.323 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.41 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 2.5 tmtp? -143.68 132.37 22.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.611 0.244 . . . . 0.0 110.413 -174.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.41 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.3 OUTLIER -95.65 141.4 29.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.335 -177.018 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -121.13 147.12 46.01 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -119.43 118.54 31.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.941 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.23 51.77 46.81 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.562 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.9 171.7 13.58 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.57 -16.95 62.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.251 0.548 . . . . 0.0 110.74 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.586 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -133.53 144.18 49.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.916 176.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.527 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.7 mppt? -98.87 -23.53 15.32 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -178.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.545 HD13 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -137.63 134.94 36.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.222 -179.125 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.484 ' N ' HD11 ' B' ' 48' ' ' LEU . 26.3 ttp180 -120.18 117.89 29.07 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.539 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -111.91 130.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.1 mm? -112.62 112.85 24.68 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.375 -176.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.16 103.38 14.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.436 ' HB3' HG21 ' B' ' 106' ' ' THR . 10.3 pt-20 -113.28 150.31 32.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.026 0.441 . . . . 0.0 110.68 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -94.93 113.7 25.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.021 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' B' ' 55' ' ' LYS . 7.2 ptmm? -137.26 93.03 2.77 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.492 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.577 175.387 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 120.694 0.283 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 p -133.45 78.74 62.14 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.455 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 86.3 Cg_endo -83.81 152.93 13.12 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.679 2.253 . . . . 0.0 112.158 179.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.49 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.9 m -156.03 141.63 17.8 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.184 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.45 ' HH ' HG12 ' B' ' 91' ' ' VAL . 51.0 t80 -99.52 129.41 45.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.326 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.536 HD22 ' HB2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -108.28 131.09 55.07 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.562 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -79.02 -24.28 43.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.332 -178.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.96 -51.71 65.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.476 . . . . 0.0 110.988 -176.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.575 ' O ' HG13 ' B' ' 74' ' ' ILE . 3.6 mt-10 -104.86 -2.34 24.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.284 178.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . 0.405 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 2.2 p-10 58.94 39.62 23.47 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.171 0.986 . . . . 0.0 110.229 174.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.575 HG13 ' O ' ' B' ' 72' ' ' GLU . 86.2 mt -118.67 136.3 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 114.447 -1.252 . . . . 0.0 111.131 -177.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -100.1 100.52 11.39 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.49 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -87.68 141.18 28.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.587 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.8 mm -90.94 -49.64 13.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.89 -175.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.2 m-20 -157.92 -170.54 3.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.39 21.19 5.35 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.398 178.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -107.07 -47.17 3.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.31 0.576 . . . . 0.0 110.038 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.489 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.7 OUTLIER -151.1 153.08 34.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.296 -178.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 24.1 p -126.97 145.51 50.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.951 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.5 102.75 39.43 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-O 120.817 0.341 . . . . 0.0 110.66 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.493 ' HA ' HG12 ' B' ' 74' ' ' ILE . 74.1 Cg_endo -78.74 134.59 12.21 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.157 1.905 . . . . 0.0 112.3 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -98.49 153.27 38.06 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.464 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.59 140.61 57.48 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.488 2.126 . . . . 0.0 111.322 175.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.61 -8.66 57.33 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.211 -176.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.75 -13.35 59.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.282 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 57.7 mt -114.15 135.15 54.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.895 -177.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 90.7 t -86.79 114.47 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . 0.45 HG12 ' HH ' ' B' ' 68' ' ' TYR . 2.0 p -123.44 134.85 65.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.329 0.585 . . . . 0.0 111.325 -175.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.477 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.06 166.43 24.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.546 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.6 -12.26 60.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.749 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.63 -9.87 48.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.37 0.605 . . . . 0.0 110.637 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.477 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.2 t70 -111.39 -24.1 10.39 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.766 -178.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.4 mt -73.73 120.1 22.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.284 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.429 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -113.82 103.05 10.81 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.69 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.44 HD13 ' HB ' ' A' ' 8' ' ' ILE . 37.5 mt -105.75 120.98 57.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.98 0.419 . . . . 0.0 111.439 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -132.85 121.25 22.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.472 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.539 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 15.5 t-80 -105.24 117.9 35.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.42 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.596 HG23 ' H ' ' B' ' 104' ' ' GLU . 2.3 mp -91.49 125.34 44.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . 0.424 ' HD3' ' OE2' ' A' ' 12' ' ' GLU . 12.1 mmm180 -76.22 -42.61 45.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.465 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -59.53 -47.82 84.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.681 -175.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.596 ' H ' HG23 ' B' ' 101' ' ' ILE . 16.0 mm-40 -87.47 -3.94 59.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.859 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 53.54 38.97 29.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.858 -175.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.436 HG21 ' HB3' ' B' ' 53' ' ' GLU . 59.6 m -125.92 137.87 53.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.93 0.395 . . . . 0.0 111.097 -172.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . 0.473 HD12 ' HB2' ' B' ' 100' ' ' HIS . 27.5 tp -109.23 119.72 40.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.181 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.545 ' CE1' HD12 ' B' ' 101' ' ' ILE . 47.4 m-85 -102.11 129.16 48.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.539 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.2 mm -115.39 118.43 58.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.808 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.429 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.7 m-85 -117.18 125.7 51.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.586 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.2 mt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.655 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 33.1 p . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 110.064 -0.346 . . . . 0.0 110.064 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -117.45 143.01 29.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.752 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.82 137.47 32.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.308 -178.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.417 ' HB ' HD13 ' B' ' 98' ' ' ILE . 4.3 mm -109.78 114.94 56.12 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.31 128.69 14.01 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.292 1.995 . . . . 0.0 112.269 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.52 132.67 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.111 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.408 HG11 HG12 ' A' ' 13' ' ' VAL . 79.4 t -94.72 114.55 31.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 174.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.47 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 23.0 mt-10 -91.1 111.2 22.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.549 0.69 . . . . 0.0 110.811 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.408 HG12 HG11 ' A' ' 11' ' ' VAL . 2.6 m -127.55 179.26 3.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.513 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -89.84 -28.05 19.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.147 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -169.64 164.14 10.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.977 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.49 HD21 ' HD2' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -78.92 143.72 62.47 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 120.692 0.282 . . . . 0.0 110.331 -178.351 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -71.35 175.04 9.92 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.917 2.412 . . . . 0.0 112.44 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.94 138.57 11.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.707 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.1 -5.09 61.09 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.166 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -106.49 149.23 27.3 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.172 0.51 . . . . 0.0 111.653 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -110.68 98.09 7.34 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.245 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.49 ' HD2' HD21 ' A' ' 16' ' ' LEU . 10.0 ttt180 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.181 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 . . . . . 0 N--CA 1.442 -0.848 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.417 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.3 m-85 -87.06 137.77 32.06 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.498 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.507 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 36.1 tt0 -110.19 113.7 26.59 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.04 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 96.8 t -93.98 124.06 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.917 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.527 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -118.58 131.76 56.2 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.22 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.539 ' HG2' HD12 ' B' ' 48' ' ' LEU . 1.5 ttt -118.91 135.78 54.4 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -176.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.479 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 5.3 tmtm? -142.57 131.65 23.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.869 0.366 . . . . 0.0 110.775 -173.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.479 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -90.5 132.04 35.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.927 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -116.69 149.01 40.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.904 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -132.29 122.62 25.42 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.547 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.03 23.85 58.65 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.307 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -113.28 170.8 7.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.79 -11.01 60.53 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 177.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.497 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.59 142.05 43.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.568 177.102 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.505 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.29 -19.69 18.38 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.148 0.499 . . . . 0.0 109.752 -175.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.539 HD12 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -135.83 132.76 37.06 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.65 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -115.93 122.02 44.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.202 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.546 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -121.41 128.95 75.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.529 HD11 ' CD2' ' B' ' 108' ' ' TYR . 3.7 mm? -114.83 120.61 40.6 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -122.12 103.56 13.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.417 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -113.06 153.49 28.05 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.147 0.499 . . . . 0.0 110.312 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.51 111.33 23.7 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.343 -176.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.413 ' HB2' ' HE2' ' B' ' 55' ' ' LYS . 7.6 ptmm? -134.7 92.19 2.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.182 0.515 . . . . 0.0 110.837 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.666 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.276 176.046 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.14 0.495 . . . . 0.0 110.539 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.4 t -134.66 79.63 52.58 Favored Pre-proline 0 C--N 1.317 -0.812 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.039 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.471 ' C ' ' HG ' ' B' ' 67' ' ' SER . 83.9 Cg_endo -84.08 158.18 13.36 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.813 2.342 . . . . 0.0 112.019 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.471 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 19.3 m -158.1 144.57 17.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.038 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.413 ' HB2' HD22 ' B' ' 75' ' ' LEU . 72.2 t80 -104.34 128.95 52.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.358 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.431 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.1 OUTLIER -109.69 125.33 52.52 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.632 178.311 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -75.72 -24.82 56.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.444 -175.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.28 -42.0 98.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.492 -175.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.55 ' O ' HD11 ' B' ' 74' ' ' ILE . 12.6 mt-10 -112.96 -7.81 13.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.291 178.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 60.52 42.35 14.36 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 124.644 1.215 . . . . 0.0 110.38 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.55 HD11 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.67 138.51 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.008 178.266 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' B' ' 68' ' ' TYR . 2.8 tm? -106.33 99.86 9.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.12 144.66 27.4 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.7 mm -105.25 -49.37 9.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.076 0.465 . . . . 0.0 111.193 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.424 ' C ' ' H ' ' B' ' 80' ' ' LYS . 0.4 OUTLIER -146.65 174.31 11.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -175.503 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.82 4.75 28.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.437 -0.887 . . . . 0.0 111.255 174.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . 0.424 ' H ' ' C ' ' B' ' 78' ' ' ASN . 30.2 mttp -101.43 -34.57 9.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.906 -0.647 . . . . 0.0 110.424 -177.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.408 ' O ' HD11 ' B' ' 81' ' ' LEU . 0.5 OUTLIER -157.62 152.51 25.48 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.56 0.695 . . . . 0.0 111.989 -177.173 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 28.4 p -133.3 143.61 49.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.805 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.5 mm -101.76 106.48 47.1 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.475 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.473 ' HA ' HD12 ' B' ' 74' ' ' ILE . 73.4 Cg_endo -82.1 135.12 8.42 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.135 1.89 . . . . 0.0 112.343 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.59 149.05 35.54 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.55 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -68.34 142.47 54.88 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.148 1.899 . . . . 0.0 111.337 175.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.451 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 8.9 mpt_? -78.74 -0.06 28.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.682 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -81.78 -15.61 53.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.043 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 51.5 mt -109.98 134.12 53.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.979 -176.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.96 114.38 25.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.64 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 51.4 t -120.6 135.5 60.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.303 0.573 . . . . 0.0 111.246 -173.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.504 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.07 161.15 38.54 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.708 177.483 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.72 64.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.799 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.62 -16.03 49.91 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.061 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.504 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.1 t0 -104.05 -22.21 13.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.603 0.715 . . . . 0.0 109.706 -177.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.2 mt -73.99 119.28 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.276 178.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -113.14 108.86 17.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.856 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.417 HD13 ' HB ' ' A' ' 8' ' ' ILE . 55.5 mt -113.33 119.5 60.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.885 0.374 . . . . 0.0 111.296 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -128.56 117.7 21.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -178.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.47 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 32.3 t-80 -100.08 121.18 41.0 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.552 HG23 ' H ' ' B' ' 104' ' ' GLU . 70.5 mt -102.84 104.84 17.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 173.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -79.05 -18.05 54.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.186 -176.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.93 -44.33 85.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.424 0.631 . . . . 0.0 109.995 174.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.552 ' H ' HG23 ' B' ' 101' ' ' ILE . 8.8 tp10 -94.24 -4.42 48.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.083 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 57.1 35.1 25.88 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.738 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 61.4 m -126.65 137.3 53.28 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.851 -174.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.4 tp -106.52 125.31 50.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.277 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.529 ' CD2' HD11 ' B' ' 51' ' ' LEU . 21.6 m-85 -105.82 126.14 51.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.835 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.546 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.0 mm -116.48 124.92 73.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.027 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -126.63 126.79 44.17 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.5 mt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.006 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 p . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.3 m -112.39 142.81 23.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.91 0.386 . . . . 0.0 110.875 -176.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.426 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -86.82 137.66 32.23 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.24 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.0 mm -109.11 121.79 41.74 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.874 -0.331 . . . . 0.0 110.272 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.2 127.83 14.78 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.368 2.045 . . . . 0.0 112.226 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 p -101.94 130.94 50.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.7 t -97.35 121.65 48.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.923 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.506 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 44.4 mt-10 -95.49 106.28 18.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.186 0.517 . . . . 0.0 110.799 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 3.6 m -128.79 -175.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.979 -177.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -99.46 -23.07 15.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.248 0.547 . . . . 0.0 109.879 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.73 156.3 36.11 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.87 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.91 146.09 48.25 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -69.24 173.66 10.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.553 2.168 . . . . 0.0 112.15 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -52.02 140.09 21.22 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.966 -177.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.34 -20.32 42.9 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.057 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -89.79 147.37 23.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.07 0.462 . . . . 0.0 111.509 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -108.02 106.47 16.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.477 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 . . . . . 0 C--N 1.324 -0.514 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.501 177.619 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 . . . . . 0 N--CA 1.445 -0.716 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.499 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 84.7 m-85 -81.87 148.36 28.84 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -124.35 115.32 20.81 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.578 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.6 p -102.41 134.86 41.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.94 -173.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.417 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -126.19 147.23 49.69 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.182 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.522 ' HG2' HD12 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -121.85 135.88 54.91 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.618 -178.464 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.499 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 4.9 tmtm? -137.05 131.94 33.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.336 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.406 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.6 OUTLIER -95.23 137.23 34.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.857 0.36 . . . . 0.0 111.101 -179.504 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.499 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 39.5 m-85 -119.62 160.5 22.37 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.733 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -143.08 121.55 12.41 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 76.8 29.58 57.24 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.447 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.03 171.73 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.44 -12.77 55.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.172 0.511 . . . . 0.0 110.485 177.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -137.75 146.55 43.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.862 177.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.512 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.58 -21.52 15.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.247 0.546 . . . . 0.0 109.609 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.03 136.99 38.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.352 -178.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.438 ' N ' HD13 ' B' ' 48' ' ' LEU . 62.9 ttp180 -124.38 121.6 35.38 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 174.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.54 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -113.73 129.86 68.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.578 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 4.4 mm? -112.36 115.09 28.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.136 -177.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.0 103.56 14.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.499 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -109.48 153.31 24.24 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.475 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . 0.458 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -94.74 114.44 26.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.994 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.408 ' N ' HD21 ' B' ' 54' ' ' ASN . 16.4 ptmt -137.94 92.18 2.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.282 0.563 . . . . 0.0 110.89 176.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.631 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 174.419 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 14.7 m -129.25 78.35 76.11 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 0.0 109.781 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.555 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 61.0 Cg_endo -81.45 145.37 14.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.317 2.011 . . . . 0.0 112.136 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.558 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.5 m -155.38 144.11 20.56 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.246 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.468 ' HH ' HG13 ' B' ' 91' ' ' VAL . 65.2 t80 -105.3 120.37 41.4 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.52 -177.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.458 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.1 p-10 -99.74 114.95 28.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.424 175.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -63.88 -32.12 73.53 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.42 -176.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.27 -41.81 69.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.973 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.537 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.98 1.79 15.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.623 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.73 45.55 21.76 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.363 1.039 . . . . 0.0 111.32 -175.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.537 HG13 ' O ' ' B' ' 72' ' ' GLU . 72.3 mt -123.26 137.62 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.135 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -105.8 107.05 17.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.558 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 10.8 p90 -95.36 144.82 25.59 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.165 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 49.3 mm -91.8 -40.77 12.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.721 -175.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.9 m-20 -161.16 -175.96 5.17 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.48 7.31 40.17 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.586 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.46 -37.99 11.15 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.074 0.464 . . . . 0.0 110.21 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.485 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.7 OUTLIER -159.26 153.01 22.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.944 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 10.1 p -128.16 141.62 51.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.642 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 45.5 mm -104.69 105.62 51.34 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.852 0.358 . . . . 0.0 110.673 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.469 ' HA ' HG12 ' B' ' 74' ' ' ILE . 73.6 Cg_endo -80.9 134.51 9.55 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.188 1.925 . . . . 0.0 112.632 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.48 143.84 27.17 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.76 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -67.27 142.2 59.63 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.133 1.889 . . . . 0.0 111.306 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -71.26 -5.01 28.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.125 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -75.31 -17.07 60.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.45 0.643 . . . . 0.0 109.709 178.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 53.5 mt -113.7 137.71 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.764 -176.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 60.6 t -90.64 113.9 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . 0.468 HG13 ' HH ' ' B' ' 68' ' ' TYR . 2.3 p -124.53 134.57 66.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.155 0.502 . . . . 0.0 111.185 -175.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 167.32 22.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.302 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.58 -23.68 64.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 111.556 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.89 -9.8 58.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.033 -177.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -113.89 -21.1 10.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.021 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 79.5 mt -75.33 117.97 20.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.354 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -113.07 107.83 16.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.68 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 46.7 mt -110.38 120.77 61.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 0.0 111.518 -177.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -133.23 119.52 19.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.614 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.506 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 16.9 t-80 -101.82 113.89 27.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.628 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.558 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.4 mt -89.93 108.43 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -69.2 -40.65 77.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.716 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -58.6 -47.44 84.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.108 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.558 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.3 tp10 -87.06 -3.19 59.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.191 -176.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 59.3 27.85 17.02 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.726 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 35.0 m -124.43 134.42 53.08 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.116 0.484 . . . . 0.0 111.231 -171.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . 0.475 HD12 ' HB2' ' B' ' 100' ' ' HIS . 37.5 tp -103.6 123.13 46.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.098 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.531 ' CE1' HD12 ' B' ' 101' ' ' ILE . 14.8 m-85 -103.83 124.43 48.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.894 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.54 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.9 mm -112.23 120.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.619 175.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.475 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.3 m-85 -118.63 125.87 50.7 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.511 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 71.7 mt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.642 -0.694 . . . . 0.0 109.986 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.454 -0.271 0 CA-C-O 120.901 0.381 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.09 164.32 34.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.349 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.03 153.75 24.18 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD13 ' B' ' 98' ' ' ILE . 5.2 mm -118.74 128.24 26.08 Favored Pre-proline 0 C--N 1.307 -1.25 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.413 -174.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.98 135.07 24.63 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.452 2.102 . . . . 0.0 111.939 177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 p -113.64 130.81 67.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.173 0.511 . . . . 0.0 110.566 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.521 HG11 ' CD2' ' B' ' 99' ' ' PHE . 4.0 p -86.22 149.03 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.512 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.571 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 34.6 mt-10 -115.81 94.46 4.69 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.595 0.712 . . . . 0.0 110.225 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 m -114.16 179.72 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.492 -177.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -95.62 -24.9 16.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.365 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -168.36 163.0 12.78 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.415 176.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.4 mt -83.48 154.02 65.57 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-O 121.066 0.46 . . . . 0.0 111.674 -175.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 165.93 31.13 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.894 2.396 . . . . 0.0 111.428 176.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.54 136.36 57.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.341 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -4.75 29.99 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.817 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -111.13 139.01 46.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.376 0.608 . . . . 0.0 111.856 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.405 ' HB2' ' HH ' ' B' ' 46' ' ' TYR . 17.1 t70 -93.74 94.69 8.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.81 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.614 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 31.6 ttp85 . . . . . 0 C--N 1.322 -0.607 0 CA-C-O 121.27 0.557 . . . . 0.0 111.54 -175.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 . . . . . 0 N--CA 1.445 -0.717 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.8 m-85 -86.04 157.68 20.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.497 -177.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.417 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 36.8 tt0 -131.51 119.18 21.19 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 171.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.79 136.32 27.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.466 -175.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -130.88 146.41 52.3 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 176.652 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.531 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.6 OUTLIER -124.75 136.64 54.04 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -177.332 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.463 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.1 tmtp? -136.58 129.49 30.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.742 0.306 . . . . 0.0 110.185 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.467 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 6.7 mpt_? -97.11 134.3 40.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.023 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.463 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.0 m-85 -114.2 164.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.454 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -144.35 119.23 9.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.784 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.72 43.79 93.56 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.804 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -124.56 171.35 10.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -19.24 65.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.293 0.568 . . . . 0.0 110.688 178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.474 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.04 136.36 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.228 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.524 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -87.68 -25.1 23.66 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.09 0.472 . . . . 0.0 110.041 -173.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.531 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.17 138.9 35.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.642 -178.215 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.498 ' N ' HD12 ' B' ' 48' ' ' LEU . 33.1 ttp180 -122.97 119.9 31.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.709 175.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.504 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.0 mp -113.64 128.06 70.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.545 HD13 ' CE2' ' B' ' 108' ' ' TYR . 3.4 mm? -110.68 117.46 33.53 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.082 -178.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -124.06 103.99 13.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.6 pt-20 -108.36 149.28 28.91 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.484 -178.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.62 113.0 24.53 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.768 -177.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -133.51 93.95 3.23 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.508 0.67 . . . . 0.0 110.74 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.807 -179.709 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.2 m -137.41 80.18 33.99 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-O 120.917 0.389 . . . . 0.0 110.096 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.482 ' C ' ' HG ' ' B' ' 67' ' ' SER . 74.3 Cg_endo -78.95 150.02 23.17 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.587 2.192 . . . . 0.0 111.948 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.482 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 9.6 m -154.65 150.05 27.25 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.426 -178.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.446 ' HB2' HD21 ' B' ' 75' ' ' LEU . 61.9 t80 -115.08 124.43 51.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.365 0.603 . . . . 0.0 111.19 -176.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.417 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.2 p-10 -105.03 113.43 27.02 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.389 174.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . 0.405 ' CD2' ' HE2' ' B' ' 68' ' ' TYR . 88.1 m-85 -63.9 -32.82 74.48 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.907 -176.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.73 70.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.727 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.516 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -109.9 2.98 20.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.208 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.83 44.7 18.31 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.477 1.11 . . . . 0.0 111.36 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.516 HG13 ' O ' ' B' ' 72' ' ' GLU . 61.6 mt -121.49 134.16 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.484 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.451 HD11 ' C ' ' B' ' 75' ' ' LEU . 3.4 tm? -101.95 107.09 18.13 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 176.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.38 140.61 29.41 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 41.2 mm -91.63 -59.62 2.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.051 0.453 . . . . 0.0 110.655 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.416 ' C ' ' H ' ' B' ' 80' ' ' LYS . 55.9 m-20 -149.68 -179.48 7.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.326 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.12 6.44 7.1 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.244 177.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . 0.416 ' H ' ' C ' ' B' ' 78' ' ' ASN . 25.9 mmmt -94.43 -43.41 8.38 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.527 HD13 ' O ' ' B' ' 81' ' ' LEU . 1.6 pp -157.82 153.72 26.89 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.708 -177.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 41.3 t -130.12 149.06 51.99 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.683 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.1 mm -112.6 105.77 55.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.897 0.38 . . . . 0.0 111.104 -174.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -79.04 136.86 13.3 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.352 2.034 . . . . 0.0 112.416 177.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.46 156.08 35.6 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.284 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . 0.403 ' HG2' HD11 ' B' ' 89' ' ' ILE . 31.9 Cg_endo -64.92 141.06 69.29 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.31 2.007 . . . . 0.0 111.492 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.519 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 8.4 mpt_? -80.1 1.81 26.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.778 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.5 -20.28 28.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.286 0.565 . . . . 0.0 109.974 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.403 HD11 ' HG2' ' B' ' 86' ' ' PRO . 62.2 mt -103.99 134.61 44.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.601 -174.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.6 t -84.17 110.13 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.696 177.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 45.2 t -111.78 132.56 60.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.499 -175.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.583 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.78 161.15 38.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.78 178.757 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.29 -18.0 63.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.699 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.65 -12.36 54.08 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.583 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 21.9 t70 -110.99 -24.04 10.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.097 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 84.6 mt -71.42 113.43 7.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.197 178.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.5 mmmt -109.54 105.7 15.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.93 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.405 HD13 ' HB ' ' A' ' 8' ' ' ILE . 57.0 mt -109.73 121.87 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.073 0.463 . . . . 0.0 111.69 -177.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . 0.521 ' CD2' HG11 ' A' ' 11' ' ' VAL . 88.3 m-85 -129.07 118.41 22.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.627 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.571 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 19.9 t-80 -99.39 106.66 18.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.097 0.475 . . . . 0.0 109.859 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.581 HD13 ' CE1' ' B' ' 108' ' ' TYR . 70.4 mt -87.24 115.24 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.698 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' B' ' 102' ' ' ARG . 33.2 mtp85 -77.25 -19.31 56.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.399 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -57.63 -48.56 79.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.767 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.482 ' H ' HG22 ' B' ' 101' ' ' ILE . 63.1 mm-40 -106.85 0.28 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.707 -179.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 54.07 40.54 31.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.83 -172.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.416 HG21 ' HB3' ' B' ' 53' ' ' GLU . 50.7 m -119.65 137.35 53.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.815 -174.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.75 119.6 39.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.424 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.614 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 24.5 m-85 -101.81 123.01 45.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.732 178.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.504 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.9 mm -113.19 119.44 60.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.947 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.42 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 88.8 m-85 -118.84 128.69 54.69 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.474 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.2 mt . . . . . 0 C--O 1.243 0.754 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.352 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.442 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.0 p . . . . . 0 N--CA 1.45 -0.462 0 CA-C-O 121.186 0.517 . . . . 0.0 111.592 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -128.53 144.19 38.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.669 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.76 137.33 33.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.904 0.383 . . . . 0.0 110.004 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.4 mm -108.05 120.31 47.29 Favored Pre-proline 0 C--N 1.316 -0.849 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.13 127.7 16.37 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.23 1.953 . . . . 0.0 112.178 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 p -102.46 127.12 56.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.381 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.465 HG13 HG12 ' A' ' 13' ' ' VAL . 47.8 t -95.02 125.73 47.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.056 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.46 ' OE1' ' HD2' ' B' ' 102' ' ' ARG . 44.3 mt-10 -90.55 107.04 18.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.215 0.531 . . . . 0.0 110.253 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.663 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 11.0 m -126.63 177.4 5.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.357 -179.221 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -98.64 -16.97 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.008 0.432 . . . . 0.0 110.03 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -170.52 159.1 6.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.574 178.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.434 HD22 ' HB2' ' A' ' 22' ' ' ARG . 2.5 mm? -76.83 150.72 81.77 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.08 172.83 13.14 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.272 1.981 . . . . 0.0 111.634 174.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.52 139.51 58.23 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.139 0.495 . . . . 0.0 111.004 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.83 -15.0 37.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.132 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -95.35 166.71 11.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.89 0.376 . . . . 0.0 111.427 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.46 ' CB ' ' HH ' ' B' ' 46' ' ' TYR . 15.3 t70 -123.41 96.25 4.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.46 -177.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.434 ' HB2' HD22 ' A' ' 16' ' ' LEU . 22.5 ttp85 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.125 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.584 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 39.0 tt0 . . . . . 0 N--CA 1.446 -0.652 0 CA-C-O 121.435 0.636 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -83.82 157.2 22.13 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.014 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -133.12 119.59 20.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.009 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.401 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.6 t -96.09 133.52 37.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.888 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.462 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.02 120.58 27.79 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.53 ' HG2' HD12 ' B' ' 48' ' ' LEU . 2.2 ttt -105.09 145.93 29.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.497 0.189 . . . . 0.0 110.614 -174.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.48 132.89 18.59 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -176.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.432 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.59 136.41 36.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.101 0.477 . . . . 0.0 110.86 179.702 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -117.57 167.65 11.12 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.363 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -156.59 109.43 2.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.938 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.4 11.85 46.85 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.305 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -111.69 171.59 7.4 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.15 -24.77 63.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.354 0.597 . . . . 0.0 110.706 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.624 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.4 p90 -124.42 142.75 51.06 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.859 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.478 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -102.04 -18.55 15.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.98 -175.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.559 HD11 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -140.23 132.93 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.823 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -119.67 120.32 36.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 177.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.559 ' CD1' HD11 ' B' ' 48' ' ' LEU . 2.0 mp -118.05 129.21 74.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.489 HD12 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.03 114.58 26.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.188 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.43 103.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -110.33 152.92 25.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.262 0.554 . . . . 0.0 111.118 -176.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . 0.434 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -94.6 113.35 25.15 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.053 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -137.94 91.48 2.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.171 0.51 . . . . 0.0 110.467 176.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.584 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.016 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.7 m -137.09 79.23 38.39 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-O 121.164 0.507 . . . . 0.0 109.829 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.431 ' C ' ' HG ' ' B' ' 67' ' ' SER . 61.3 Cg_endo -76.27 153.0 35.55 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.865 2.377 . . . . 0.0 112.668 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.431 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 14.9 m -153.91 147.33 24.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.138 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.481 ' HH ' HG13 ' B' ' 91' ' ' VAL . 34.9 t80 -103.92 120.73 41.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.304 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.517 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.8 p-10 -100.2 112.38 24.7 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.386 176.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -63.1 -33.21 74.95 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.595 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.13 77.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.875 -175.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.49 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -112.45 3.4 16.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.257 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . 0.453 HD22 ' NE ' ' B' ' 87' ' ' ARG . 2.2 p-10 47.05 45.77 15.85 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.38 1.072 . . . . 0.0 111.616 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.517 ' HB ' HD22 ' B' ' 69' ' ' ASN . 63.7 mt -121.4 139.29 48.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.065 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -102.22 102.54 12.96 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.0 140.88 29.42 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -177.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -94.75 -54.43 7.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.469 -177.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -149.64 178.79 8.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.49 6.6 15.87 Favored Glycine 0 CA--C 1.517 0.184 0 C-N-CA 120.659 -0.781 . . . . 0.0 111.939 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -96.21 -37.3 10.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.49 . . . . 0.0 110.066 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.46 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.6 OUTLIER -158.01 151.92 24.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 112.094 178.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.0 p -128.78 148.72 50.88 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.67 177.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.5 mm -105.86 104.25 48.09 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.896 0.379 . . . . 0.0 110.391 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.51 ' HA ' HG12 ' B' ' 74' ' ' ILE . 61.4 Cg_endo -75.48 131.76 14.1 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.245 1.963 . . . . 0.0 112.211 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 54.0 mt -101.32 146.5 32.3 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.237 -175.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.65 142.85 65.82 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.276 1.984 . . . . 0.0 111.4 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.453 ' NE ' HD22 ' B' ' 73' ' ' ASN . 9.2 mpt_? -78.24 1.01 22.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.533 -175.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -93.28 -1.4 56.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.579 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 60.0 mt -116.73 137.92 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 67.1 t -87.03 113.02 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . 0.481 HG13 ' HH ' ' B' ' 68' ' ' TYR . 1.6 p -125.27 132.49 71.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.311 0.577 . . . . 0.0 111.393 -174.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.464 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -142.37 163.64 32.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.028 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.23 63.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.67 -13.4 51.59 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.464 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 31.3 t70 -111.28 -21.19 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.111 -175.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.0 mt -75.73 118.56 22.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.169 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.442 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.1 mmmt -111.98 107.72 16.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.114 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 53.4 mt -111.42 121.43 63.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.983 0.421 . . . . 0.0 111.364 -178.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -132.66 122.53 24.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.205 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.417 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 45.3 t60 -102.86 110.7 22.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.998 0.428 . . . . 0.0 110.752 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.663 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 56.1 mt -91.16 114.18 28.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.195 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . 0.46 ' HD2' ' OE1' ' A' ' 12' ' ' GLU . 39.5 mtp85 -81.06 -26.09 36.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.126 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.4 tttp -58.55 -42.31 87.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.337 177.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.571 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.6 tp10 -105.29 1.7 28.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.306 0.574 . . . . 0.0 110.002 -177.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 55.47 31.47 17.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.903 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 37.2 m -123.49 139.95 53.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 121.015 0.436 . . . . 0.0 110.939 -173.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.53 121.32 44.05 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.799 178.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.618 ' CE1' HD12 ' B' ' 101' ' ' ILE . 8.4 m-85 -100.42 126.36 46.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.245 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.514 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 39.0 mm -115.94 117.73 56.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.732 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.442 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 87.3 m-85 -119.01 123.04 43.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.624 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 68.1 mt . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.745 -0.645 . . . . 0.0 109.807 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.465 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 39.2 p . . . . . 0 N--CA 1.446 -0.667 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.0 m -120.66 140.1 45.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.013 -179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.54 139.45 30.84 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.768 -179.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.1 mm -112.13 119.6 43.67 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -70.54 128.73 15.71 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.236 1.957 . . . . 0.0 112.105 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.0 t -83.58 135.45 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.135 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.493 HG13 HG13 ' A' ' 13' ' ' VAL . 38.6 t -99.18 111.07 27.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.5 ' OE1' ' HD3' ' B' ' 102' ' ' ARG . 45.1 mt-10 -85.9 102.21 13.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 0.0 110.605 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.493 HG13 HG13 ' A' ' 11' ' ' VAL . 5.8 m -123.16 -176.46 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.072 -178.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -94.43 -29.96 14.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -162.61 162.93 27.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.534 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.429 HD21 ' HB2' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -81.72 143.45 50.61 Favored Pre-proline 0 N--CA 1.448 -0.539 0 CA-C-O 120.776 0.322 . . . . 0.0 110.817 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -51.62 171.0 0.16 Allowed 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 123.931 3.087 . . . . 0.0 113.469 174.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -65.59 141.13 58.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.494 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.48 -4.6 60.09 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.493 -0.861 . . . . 0.0 111.22 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.71 164.76 11.72 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.48 94.36 4.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.042 0.449 . . . . 0.0 111.563 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.429 ' HB2' HD21 ' A' ' 16' ' ' LEU . 13.4 ttp180 . . . . . 0 C--N 1.321 -0.65 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.403 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.1 tt0 . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.504 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.8 m-85 -86.39 156.51 20.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.602 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.522 ' OE2' ' HE2' ' B' ' 37' ' ' LYS . 35.0 tt0 -129.24 118.64 22.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.506 -0.77 . . . . 0.0 108.983 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -94.29 133.88 33.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.412 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.522 ' HE2' ' OE2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -128.84 145.41 51.21 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.382 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.483 ' HG2' HD13 ' B' ' 48' ' ' LEU . 1.5 ttt -125.68 138.38 53.89 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.442 -178.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.591 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 6.6 tmtm? -142.13 135.12 28.74 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -173.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.433 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 7.7 mpt_? -99.07 133.33 43.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.813 0.339 . . . . 0.0 111.122 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.591 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 45.8 m-85 -118.44 150.79 38.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.619 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -134.39 120.94 20.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.642 177.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.36 26.49 51.54 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.578 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.22 171.81 8.03 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -20.53 65.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.335 0.588 . . . . 0.0 110.391 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.573 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -126.38 142.01 51.69 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.518 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.6 mppt? -101.81 -21.53 14.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.498 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.76 130.52 25.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.899 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -116.11 129.73 56.47 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.498 ' CD1' HD12 ' B' ' 48' ' ' LEU . 2.7 mp -122.06 130.64 74.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.532 HD12 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -116.47 123.59 47.86 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.277 -176.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.7 mp -125.61 103.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.545 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.504 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.1 pt-20 -108.38 153.6 23.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.949 0.404 . . . . 0.0 110.191 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.18 113.6 25.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.662 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -135.65 93.19 2.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.6 0.714 . . . . 0.0 110.318 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.403 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.48 -179.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 . . . . . 0 CA--C 1.516 -0.365 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.2 m -130.58 78.81 73.35 Favored Pre-proline 0 C--N 1.318 -0.769 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.208 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.466 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 94.8 Cg_endo -84.54 156.02 12.23 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.557 2.171 . . . . 0.0 112.492 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.8 p -162.11 139.67 8.56 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.112 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.419 ' HB2' HD21 ' B' ' 75' ' ' LEU . 60.7 t80 -104.34 128.05 52.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.436 -178.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.513 HD22 ' HB2' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -105.37 132.59 51.37 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -79.61 -25.74 41.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.499 -178.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.66 -51.11 66.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.143 0.496 . . . . 0.0 110.841 -175.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.513 ' HB2' HD22 ' B' ' 69' ' ' ASN . 2.4 mt-10 -104.68 -3.39 23.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.15 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . 0.481 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 2.3 p-10 57.74 43.67 21.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.088 0.947 . . . . 0.0 110.909 173.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.413 HG13 ' O ' ' B' ' 72' ' ' GLU . 62.4 mt -119.84 134.28 63.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.14 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.419 HD21 ' HB2' ' B' ' 68' ' ' TYR . 2.6 tm? -105.48 103.3 12.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.971 178.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.466 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -91.43 146.56 23.7 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.54 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 40.3 mm -99.01 -51.86 9.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.481 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.477 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.9 m-20 -155.67 179.48 9.15 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.31 33.92 1.12 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.381 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . 0.477 ' H ' ' C ' ' B' ' 78' ' ' ASN . 31.5 mmtp -124.12 -42.04 2.17 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.475 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.7 OUTLIER -155.23 153.39 30.58 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.802 -178.191 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 54.9 p -127.69 141.76 51.52 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.231 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -104.67 104.65 46.78 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-O 120.815 0.34 . . . . 0.0 110.63 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.05 132.9 8.65 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 122.213 1.942 . . . . 0.0 111.942 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -95.58 147.36 32.88 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.892 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . 0.411 ' HG2' HD13 ' B' ' 89' ' ' ILE . 34.8 Cg_endo -66.11 139.02 54.15 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.188 1.926 . . . . 0.0 111.396 176.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.02 -5.13 39.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.553 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.89 -20.09 58.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.842 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.411 HD13 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -111.67 137.26 45.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.446 -176.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 6.4 p -88.57 122.71 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 47.5 t -122.55 136.09 60.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.723 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.54 164.15 30.99 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.763 176.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.04 -22.37 66.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.144 0.497 . . . . 0.0 111.197 -176.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -11.88 57.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.867 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.723 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 15.5 t70 -105.18 -25.06 12.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.511 -177.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 72.0 mt -75.66 119.13 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.433 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -113.23 100.34 8.5 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.753 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 45.3 mt -104.44 118.43 51.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 121.026 0.441 . . . . 0.0 111.211 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -129.8 119.02 22.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.574 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.425 ' HB2' HD12 ' B' ' 107' ' ' LEU . 85.2 t60 -101.57 121.49 42.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.81 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.46 HG22 ' H ' ' B' ' 104' ' ' GLU . 76.9 mt -101.86 116.2 45.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.463 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . 0.5 ' HD3' ' OE1' ' A' ' 12' ' ' GLU . 21.4 mtm180 -81.2 -39.77 24.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.647 -174.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.41 -32.54 71.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.337 0.589 . . . . 0.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.46 ' H ' HG22 ' B' ' 101' ' ' ILE . 32.6 tt0 -101.36 -5.47 25.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.129 -178.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 34.5 mtm180 51.03 37.77 18.76 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.766 -1.107 . . . . 0.0 111.779 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 45.7 m -128.41 139.68 52.23 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.797 -175.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' B' ' 100' ' ' HIS . 52.5 tp -111.19 117.19 32.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.532 ' CE2' HD12 ' B' ' 51' ' ' LEU . 44.0 m-85 -98.62 124.5 43.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.322 -178.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.43 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 45.0 mm -113.11 117.01 54.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.108 178.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.473 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 72.8 m-85 -118.71 127.66 53.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 177.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.573 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 64.1 mt . . . . . 0 C--O 1.248 1.013 0 CA-C-O 119.035 -0.507 . . . . 0.0 109.778 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 21.2 p . . . . . 0 N--CA 1.448 -0.571 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.416 ' CG2' ' HB3' ' B' ' 93' ' ' ALA . 16.4 m -116.76 136.61 53.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.448 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.8 138.11 31.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -176.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.422 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.13 121.11 42.62 Favored Pre-proline 0 C--N 1.319 -0.751 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.351 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.91 135.54 23.54 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 122.58 2.187 . . . . 0.0 112.482 178.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.428 HG12 HG23 ' B' ' 98' ' ' ILE . 26.0 t -98.8 134.75 36.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.982 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.499 ' O ' HG12 ' A' ' 11' ' ' VAL . 3.6 p -89.6 148.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.517 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -115.27 94.22 4.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.733 0.778 . . . . 0.0 110.237 170.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.1 m -115.43 -171.75 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.358 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -99.19 -30.75 12.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -153.82 178.05 10.33 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.406 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -84.6 149.36 54.18 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.393 173.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.427 ' HG2' ' CE1' ' A' ' 20' ' ' TYR . 39.7 Cg_endo -68.94 165.21 30.76 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.046 1.831 . . . . 0.0 111.472 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.05 135.41 56.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.097 0.475 . . . . 0.0 110.869 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.46 -5.27 29.77 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.815 -174.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.427 ' CE1' ' HG2' ' A' ' 17' ' ' PRO . 65.0 m-85 -106.35 176.8 5.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 0.0 111.318 177.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -131.54 97.35 4.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.538 -178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.584 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 64.3 ttp85 . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.501 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.432 ' H ' ' HB1' ' B' ' 56' ' ' ALA . 33.7 tt0 . . . . . 0 N--CA 1.443 -0.801 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.489 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.9 m-85 -83.11 148.17 27.66 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.753 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -120.37 114.66 22.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.283 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 82.8 t -94.62 125.22 47.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.503 -178.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -123.23 142.49 50.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.204 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.504 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.5 OUTLIER -127.4 137.83 52.84 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 121.169 -0.212 . . . . 0.0 110.552 -174.504 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.497 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.5 tmtt? -145.58 132.9 20.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.653 0.263 . . . . 0.0 110.362 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.497 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -93.09 139.56 30.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.358 -177.835 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.432 ' CE2' ' HE1' ' B' ' 46' ' ' TYR . 23.9 m-85 -121.49 167.67 12.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.31 176.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -156.4 112.0 2.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.075 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 97.66 16.81 32.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.056 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.09 172.09 7.27 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.7 -18.91 63.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.114 0.483 . . . . 0.0 110.87 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.556 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 2.4 p90 -130.69 147.85 52.41 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.518 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.43 -20.07 14.19 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.203 0.525 . . . . 0.0 109.806 -177.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.504 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -136.23 133.52 37.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.498 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.7 ttp180 -115.83 115.6 26.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.405 176.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.549 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -114.64 131.86 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.543 HD11 ' CD2' ' B' ' 108' ' ' TYR . 4.2 mm? -115.23 122.91 47.44 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.989 -178.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.63 103.46 11.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 176.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.489 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.8 pt-20 -113.05 153.42 28.16 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.072 0.463 . . . . 0.0 110.477 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . 0.423 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -96.37 110.05 22.46 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.885 -177.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -135.67 93.17 2.91 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.509 0.671 . . . . 0.0 110.775 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.432 ' HB1' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.325 -0.492 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.26 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 38.7 m -133.55 78.8 61.41 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-O 121.009 0.433 . . . . 0.0 110.104 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.588 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 93.2 Cg_endo -82.09 150.89 15.93 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.569 2.179 . . . . 0.0 112.193 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.496 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 15.1 m -158.33 144.71 17.31 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.125 -179.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.455 ' CZ ' HG12 ' B' ' 91' ' ' VAL . 45.2 t80 -102.71 118.3 36.54 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.615 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.401 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.1 p-10 -101.18 115.84 31.42 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.753 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -63.8 -26.26 68.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.619 -178.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.13 63.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.784 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.585 ' O ' HG13 ' B' ' 74' ' ' ILE . 11.2 mt-10 -112.08 2.44 16.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.16 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 47.69 46.02 18.12 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.54 1.15 . . . . 0.0 110.811 -174.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.585 HG13 ' O ' ' B' ' 72' ' ' GLU . 84.7 mt -120.85 137.09 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.097 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.406 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.3 tm? -100.11 100.71 11.61 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 177.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.588 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -87.82 137.61 32.19 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.597 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.2 mm -89.79 -49.11 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.403 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -151.59 -177.57 6.18 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.55 0.96 54.03 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.238 -0.982 . . . . 0.0 111.918 176.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -94.25 -34.77 12.74 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.81 0.338 . . . . 0.0 110.411 -176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.436 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.4 OUTLIER -157.0 152.39 26.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.802 178.041 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' SER . . . . . 0.446 ' O ' ' HD3' ' B' ' 84' ' ' PRO . 35.8 p -128.45 150.0 50.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.105 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -107.77 98.82 26.65 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-O 120.821 0.344 . . . . 0.0 110.553 -179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.559 ' HA ' HG12 ' B' ' 74' ' ' ILE . 14.5 Cg_exo -70.53 135.95 29.81 Favored 'Trans proline' 0 CA--C 1.515 -0.429 0 C-N-CA 122.558 2.172 . . . . 0.0 112.127 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.03 147.84 35.17 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.257 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . 0.407 ' HG2' HD11 ' B' ' 89' ' ' ILE . 36.8 Cg_endo -66.96 139.27 50.8 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.251 1.967 . . . . 0.0 111.64 178.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -7.72 52.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.683 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -80.41 -13.74 58.89 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.636 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.407 HD11 ' HG2' ' B' ' 86' ' ' PRO . 61.1 mt -113.9 133.44 59.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.058 -174.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 8.8 p -83.94 125.57 40.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.464 176.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . 0.455 HG12 ' CZ ' ' B' ' 68' ' ' TYR . 2.3 p -137.23 137.45 46.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 111.447 -174.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.613 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -139.73 165.62 26.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.618 177.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . 0.416 ' HB3' ' CG2' ' A' ' 6' ' ' VAL . . . -59.54 -25.89 64.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.291 0.567 . . . . 0.0 111.237 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.95 -12.98 59.29 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.613 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 23.0 t0 -106.01 -22.57 12.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 0.0 109.639 -177.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 75.4 mt -76.39 117.11 20.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.417 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.9 mmmt -110.96 109.45 19.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.157 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.428 HG23 HG12 ' A' ' 10' ' ' VAL . 50.8 mt -113.48 118.01 57.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 121.206 0.526 . . . . 0.0 111.401 -178.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . 0.496 ' CD2' HG13 ' A' ' 11' ' ' VAL . 73.7 m-85 -128.06 117.67 22.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.475 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.517 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 20.6 t-80 -98.96 110.08 22.74 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.027 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.575 HG23 ' H ' ' B' ' 104' ' ' GLU . 3.7 mp -91.82 109.05 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -81.08 -17.74 49.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.593 -174.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -70.07 -47.61 61.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.14 0.495 . . . . 0.0 110.076 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.575 ' H ' HG23 ' B' ' 101' ' ' ILE . 18.5 mm-40 -86.71 -1.8 58.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.256 177.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 53.02 38.5 27.46 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.576 -176.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 40.1 m -125.88 128.12 47.09 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.099 0.476 . . . . 0.0 110.956 -173.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . 0.405 HD12 ' CG2' ' B' ' 98' ' ' ILE . 45.1 tp -98.9 112.57 24.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.907 177.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.584 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 61.2 m-85 -91.99 123.13 35.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.952 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.549 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.7 mm -112.12 124.9 69.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.961 177.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.475 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 87.8 m-85 -126.9 123.73 37.91 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.457 -0.783 . . . . 0.0 110.109 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 N--CA 1.451 -0.415 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.6 m -130.18 148.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.886 0.374 . . . . 0.0 110.569 -178.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.429 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -92.3 138.96 31.08 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.6 mm -107.73 122.95 39.34 Favored Pre-proline 0 C--N 1.32 -0.677 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.467 -176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.11 129.02 15.55 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.293 1.995 . . . . 0.0 112.015 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 p -104.67 135.3 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.311 0.577 . . . . 0.0 110.869 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.485 HG11 ' CD2' ' B' ' 99' ' ' PHE . 3.5 p -86.53 148.8 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.632 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 44.2 mt-10 -115.23 93.75 4.43 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.565 0.698 . . . . 0.0 110.047 170.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.482 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 12.6 m -116.06 -173.44 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.938 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.54 -22.48 16.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.569 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -169.98 172.95 6.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.395 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.411 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -76.13 150.53 83.22 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.38 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.4 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 51.1 Cg_endo -71.64 172.91 13.42 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 121.948 1.765 . . . . 0.0 111.968 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -53.52 138.53 33.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.315 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.29 -9.61 53.89 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.64 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.4 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 60.7 m-85 -99.92 143.07 30.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 0.0 111.969 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -96.2 95.58 8.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.619 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.452 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 18.2 ttt180 . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.702 -175.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 N--CA 1.449 -0.524 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -87.56 153.64 21.24 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.496 176.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -125.89 118.18 24.91 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.77 126.87 48.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.869 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.58 119.12 26.29 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.562 ' HG2' HD12 ' B' ' 48' ' ' LEU . 1.2 ttt -101.85 139.64 37.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -144.98 131.65 19.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.769 0.319 . . . . 0.0 110.621 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' B' ' 40' ' ' ARG . 8.6 mmt180 -87.99 143.12 27.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.511 0.672 . . . . 0.0 112.586 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -131.17 152.48 50.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.074 176.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -140.97 116.3 10.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.292 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.98 16.95 58.72 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.148 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.27 172.06 7.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.758 0.313 . . . . 0.0 110.721 -177.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.02 -3.54 16.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.124 0.488 . . . . 0.0 110.864 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.431 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -147.42 140.21 24.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.534 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.1 mppt? -94.28 -23.29 17.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.268 0.556 . . . . 0.0 109.646 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.562 HD12 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -135.74 134.0 38.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.16 179.877 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.518 ' N ' HD13 ' B' ' 48' ' ' LEU . 49.7 ttp180 -116.54 123.01 46.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.476 174.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.517 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.0 mp -119.7 127.83 75.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.508 HD13 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -113.01 118.48 34.94 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -121.81 102.88 12.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 176.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.4 pt-20 -108.79 153.95 22.76 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.353 -178.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -97.67 115.34 27.75 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ptmm? -137.55 91.41 2.59 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.386 176.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.562 172.3 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 49.9 m -134.9 78.96 53.02 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.453 ' C ' ' HG ' ' B' ' 67' ' ' SER . 64.3 Cg_endo -78.93 150.27 23.41 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.609 2.206 . . . . 0.0 112.255 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.453 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 11.4 m -155.86 147.47 22.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.384 -178.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.486 ' HH ' HG11 ' B' ' 91' ' ' VAL . 55.0 t80 -109.8 118.58 36.87 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.709 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.401 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.4 p-10 -99.14 113.2 25.31 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.482 175.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -62.82 -32.66 73.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.907 -175.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.92 72.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.959 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.459 ' O ' HG13 ' B' ' 74' ' ' ILE . 12.1 mm-40 -112.17 1.06 16.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.198 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 47.47 46.55 17.43 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 124.521 1.138 . . . . 0.0 111.487 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.459 HG13 ' O ' ' B' ' 72' ' ' GLU . 59.3 mt -120.5 136.99 55.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.155 -178.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.438 HD22 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -103.36 101.31 11.22 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.424 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -88.76 143.52 26.86 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -178.575 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 48.1 mm -96.11 -60.89 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.271 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.32 -171.56 3.87 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.72 2.27 41.23 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.105 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -85.63 -45.78 11.39 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.506 0.67 . . . . 0.0 109.344 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.492 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.6 OUTLIER -159.32 153.45 23.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.134 -176.108 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 26.7 p -124.49 148.43 47.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.799 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.73 102.07 36.36 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.804 0.335 . . . . 0.0 110.456 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.456 ' HA ' HG12 ' B' ' 74' ' ' ILE . 57.6 Cg_endo -74.22 131.82 15.75 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.081 1.854 . . . . 0.0 111.708 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.5 mt -102.28 146.76 32.9 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.236 -175.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -69.05 139.86 43.78 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.194 1.929 . . . . 0.0 111.673 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.26 -3.11 24.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.468 -176.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -81.26 -13.28 58.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.2 mt -112.52 134.72 54.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.684 -177.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 95.3 t -87.52 109.23 19.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . 0.486 HG11 ' HH ' ' B' ' 68' ' ' TYR . 2.2 p -119.95 135.79 59.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.255 0.55 . . . . 0.0 111.11 -173.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.466 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -139.82 165.82 26.27 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 179.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.89 -20.3 63.59 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.491 0.494 . . . . 0.0 111.682 -176.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.7 -14.12 46.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.466 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 28.7 t0 -105.78 -23.97 12.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.723 0.773 . . . . 0.0 109.768 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.09 117.08 14.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.387 177.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -110.91 108.27 18.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.091 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 54.3 mt -112.74 119.74 61.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.203 -177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . 0.485 ' CD2' HG11 ' A' ' 11' ' ' VAL . 75.7 m-85 -128.71 117.01 20.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.87 -178.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.508 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 17.4 t-80 -98.55 113.83 26.01 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.905 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.53 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.8 mp -91.11 126.07 43.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 75.1 mtm180 -80.72 -45.43 17.11 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.354 -173.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.74 -47.5 83.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -177.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.53 ' H ' HG22 ' B' ' 101' ' ' ILE . 45.2 mm-40 -81.62 -1.05 45.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' B' ' 104' ' ' GLU . 12.5 ptm180 44.12 41.79 4.44 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.166 0.916 . . . . 0.0 111.42 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -127.46 141.77 51.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.834 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.76 118.66 35.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.41 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.508 ' CE2' HD13 ' B' ' 51' ' ' LEU . 38.4 m-85 -98.62 131.48 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.36 -179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.517 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.6 mm -119.74 123.01 70.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.068 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -123.53 130.39 52.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 176.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.431 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.915 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.9 p . . . . . 0 N--CA 1.451 -0.405 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.0 m -128.32 152.24 36.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.552 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.05 136.88 32.91 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.4 mm -106.5 124.11 36.7 Favored Pre-proline 0 C--N 1.319 -0.745 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.186 -178.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.3 136.87 32.6 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.403 2.069 . . . . 0.0 112.067 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.3 134.11 58.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.267 0.556 . . . . 0.0 110.744 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.53 HG11 ' CD2' ' B' ' 99' ' ' PHE . 4.1 p -89.09 149.12 4.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.664 -179.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 47.5 mt-10 -107.59 94.92 5.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 169.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 9.0 m -117.28 -176.11 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.586 -178.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -104.07 -29.68 10.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 176.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -151.93 166.46 31.42 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.01 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -84.04 151.33 60.21 Favored Pre-proline 0 N--CA 1.444 -0.736 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.879 177.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -53.69 167.57 0.97 Allowed 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 123.523 2.816 . . . . 0.0 113.588 175.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -63.21 130.14 43.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.639 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.6 -9.75 38.16 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.797 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.1 164.1 13.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 111.561 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -103.57 153.83 20.16 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.373 175.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 ttp85 . . . . . 0 C--N 1.321 -0.646 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 171.281 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.461 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 31.0 tt0 . . . . . 0 N--CA 1.446 -0.638 0 CA-C-O 121.472 0.653 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.403 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 90.3 m-85 -85.23 146.14 27.22 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.771 179.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.409 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 29.7 tt0 -119.16 108.5 14.74 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 176.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.502 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.4 p -96.98 137.25 25.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.48 -175.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.446 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.51 146.28 50.87 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.155 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.418 ' HG2' HD12 ' B' ' 48' ' ' LEU . 2.0 ttt -126.13 143.08 51.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.506 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 7.8 tmtm? -147.03 137.99 23.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -176.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.504 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 8.0 mpt_? -99.08 139.48 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.02 0.438 . . . . 0.0 110.725 -178.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.506 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.8 m-85 -127.02 157.07 40.56 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.222 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . 0.502 ' HZ2' ' HB2' ' B' ' 42' ' ' LYS . 0.0 OUTLIER -156.75 110.18 2.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.654 175.181 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 113.98 -1.34 24.27 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.14 171.83 7.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.567 -0.316 . . . . 0.0 110.328 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.86 -18.48 64.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.201 0.524 . . . . 0.0 110.779 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.57 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -126.39 143.04 51.31 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.805 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.524 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.54 -17.48 15.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.164 0.507 . . . . 0.0 109.832 -176.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.522 HD11 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -141.21 132.74 26.97 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.157 179.306 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.629 ' HG3' ' CE1' ' B' ' 110' ' ' TYR . 19.3 ttp180 -115.65 129.27 56.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.794 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.522 ' CD1' HD11 ' B' ' 48' ' ' LEU . 2.3 mp -125.82 127.13 71.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 176.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 0.9 OUTLIER -115.32 119.55 36.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.195 -177.032 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.16 104.21 14.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.403 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -107.78 152.22 24.66 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -103.83 116.12 31.71 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.898 0.38 . . . . 0.0 110.661 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -137.72 93.27 2.77 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.694 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.461 ' HB3' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.253 176.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 . . . . . 0 CA--C 1.513 -0.464 0 CA-C-O 120.754 0.312 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.3 p -135.12 79.54 50.04 Favored Pre-proline 0 C--N 1.317 -0.808 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.485 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.9 Cg_endo -79.44 145.83 18.97 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.379 2.052 . . . . 0.0 112.338 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.412 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 14.2 m -153.42 147.74 25.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.45 -177.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.459 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.5 t80 -113.01 127.64 56.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.081 0.467 . . . . 0.0 111.043 -176.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.458 HD22 ' HB ' ' B' ' 74' ' ' ILE . 2.2 p-10 -105.33 116.46 31.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.172 174.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -65.9 -32.89 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.608 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.32 -53.3 55.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.535 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -105.74 7.96 32.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.713 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.72 42.37 19.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.128 0.971 . . . . 0.0 111.752 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.6 mt -116.04 137.89 48.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.489 -178.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -108.14 107.02 17.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.485 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -94.07 136.36 34.44 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.211 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 34.5 mm -90.98 -47.93 14.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.107 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.423 ' C ' ' H ' ' B' ' 80' ' ' LYS . 8.3 t-20 -159.2 175.61 13.23 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 -173.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.24 9.65 12.73 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.296 174.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' B' ' 78' ' ' ASN . 67.5 mmtt -99.54 -37.69 9.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.449 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.7 OUTLIER -162.47 153.69 17.77 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.492 0.663 . . . . 0.0 112.003 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.9 t -129.42 147.89 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.909 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mm -111.39 106.67 57.12 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.999 0.428 . . . . 0.0 110.966 -175.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.42 ' HA ' HG12 ' B' ' 74' ' ' ILE . 59.0 Cg_endo -74.94 134.36 17.82 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.155 1.903 . . . . 0.0 111.67 177.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 74.6 mt -102.37 154.95 37.07 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.684 -175.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . 0.403 ' HG2' HD13 ' B' ' 89' ' ' ILE . 40.1 Cg_endo -68.95 141.88 49.88 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.229 1.953 . . . . 0.0 111.865 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.92 -3.14 46.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.486 -176.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.62 -9.36 56.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.287 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.403 HD13 ' HG2' ' B' ' 86' ' ' PRO . 61.2 mt -114.04 134.19 57.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.478 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.25 111.66 22.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 58.6 t -116.05 133.7 61.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.145 0.498 . . . . 0.0 111.038 -173.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.455 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.36 160.75 39.47 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.405 177.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.97 -20.62 64.04 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.173 0.511 . . . . 0.0 111.588 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -12.99 56.66 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.249 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.455 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.9 t70 -110.07 -24.31 10.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.493 0.663 . . . . 0.0 109.812 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 86.7 mt -69.69 118.35 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.168 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -112.98 107.38 15.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.9 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 56.8 mt -110.28 121.76 63.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 111.428 -178.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . 0.53 ' CD2' HG11 ' A' ' 11' ' ' VAL . 78.8 m-85 -129.12 118.84 23.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.199 -179.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.509 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 23.8 t-80 -104.44 108.64 20.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.136 0.493 . . . . 0.0 110.41 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.563 HG22 ' H ' ' B' ' 104' ' ' GLU . 66.2 mt -86.73 98.61 7.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.439 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . 0.415 ' HD2' ' OE2' ' A' ' 12' ' ' GLU . 14.2 ptm180 -74.8 -10.96 60.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.508 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.39 -43.15 74.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.386 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.563 ' H ' HG22 ' B' ' 101' ' ' ILE . 30.0 mm-40 -99.9 -6.86 26.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.454 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 61.35 36.96 17.3 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.502 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 19.4 m -123.26 142.26 51.11 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.373 -176.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.15 121.59 44.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.161 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.476 ' CE1' HD12 ' B' ' 101' ' ' ILE . 17.7 m-85 -106.17 130.19 54.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.163 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.511 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.4 mm -118.11 124.43 73.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.629 ' CE1' ' HG3' ' B' ' 49' ' ' ARG . 98.9 m-85 -128.62 125.02 37.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.908 0.385 . . . . 0.0 110.288 177.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.57 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 56.2 mt . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.648 -0.692 . . . . 0.0 109.718 -179.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.8 p . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.409 ' CG2' ' HB3' ' B' ' 93' ' ' ALA . 15.6 m -121.38 138.79 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.047 0.451 . . . . 0.0 111.659 -173.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.23 138.27 32.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.843 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.45 ' HB ' HD13 ' B' ' 98' ' ' ILE . 4.9 mm -110.06 117.44 51.81 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -177.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.75 128.28 17.68 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.427 2.085 . . . . 0.0 112.38 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 43.5 t -91.78 131.38 39.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.665 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.472 HG13 ' HA ' ' B' ' 99' ' ' PHE . 2.3 p -87.08 147.57 5.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.0 mt-10 -115.29 93.98 4.53 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 119.705 -0.798 . . . . 0.0 109.682 168.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.9 m -110.92 -179.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.637 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -86.25 -32.63 21.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.519 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.7 pt-20 -170.48 172.05 6.19 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.678 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.7 144.08 72.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-O 120.542 0.21 . . . . 0.0 110.45 -179.355 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -68.08 172.53 10.78 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.278 1.986 . . . . 0.0 111.955 178.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -57.05 133.64 55.14 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.488 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.25 -11.31 31.25 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.245 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -97.58 159.49 14.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 0.0 111.472 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -114.81 95.23 5.12 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.792 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.061 177.795 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.481 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 34.2 tt0 . . . . . 0 N--CA 1.444 -0.748 0 CA-C-O 121.417 0.627 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.2 m-85 -86.89 138.58 31.43 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.487 175.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.428 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 22.8 tt0 -118.75 110.04 16.79 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.508 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.1 p -97.53 131.71 43.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.358 -174.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.428 ' HE2' ' HG2' ' B' ' 35' ' ' GLU . 0.1 OUTLIER -124.0 132.34 53.69 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.509 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.497 ' HG2' HD13 ' B' ' 48' ' ' LEU . 2.1 ttt -113.79 143.24 44.98 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.782 -176.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.512 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 7.0 tmtm? -149.47 135.49 18.88 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.12 -0.232 . . . . 0.0 110.473 -176.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.512 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER -92.28 128.98 38.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.009 0.433 . . . . 0.0 111.017 178.419 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.47 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 11.3 m-85 -114.56 138.98 49.97 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.805 176.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -138.55 106.61 5.72 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.164 0.506 . . . . 0.0 109.719 176.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 122.19 2.84 9.93 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.741 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -114.6 171.63 7.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.76 -21.06 65.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.341 0.591 . . . . 0.0 110.551 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.648 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.8 p90 -119.28 141.65 48.78 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.789 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.507 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.6 mppt? -105.42 -15.39 15.03 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.454 0.645 . . . . 0.0 109.81 -175.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.553 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.11 130.42 28.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.889 177.503 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 17.8 ttp180 -119.47 123.5 44.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.892 177.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.553 ' CD1' HD12 ' B' ' 48' ' ' LEU . 1.9 mp -120.54 127.21 75.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.5 mm? -110.1 112.27 24.15 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.046 -178.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -120.02 103.88 14.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.6 pt-20 -109.58 153.3 24.36 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.633 -178.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.56 108.12 20.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.723 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -135.39 92.37 2.84 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.41 0.624 . . . . 0.0 110.255 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.481 ' HB3' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.317 -0.806 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.938 176.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 . . . . . 0 CA--C 1.517 -0.326 0 CA-C-O 120.939 0.4 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 41.5 m -138.67 80.3 26.31 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.863 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.466 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 90.1 Cg_endo -82.92 162.23 15.93 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.87 2.38 . . . . 0.0 112.213 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.5 p -162.71 136.49 6.16 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.545 ' HH ' HG12 ' B' ' 91' ' ' VAL . 52.0 t80 -98.23 115.76 29.04 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.492 -179.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.49 114.71 26.39 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.706 176.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -63.66 -25.05 68.04 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.428 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.86 71.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.845 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.478 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.56 3.91 17.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.358 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . 0.542 HD22 ' NE ' ' B' ' 87' ' ' ARG . 2.5 p-10 47.54 45.33 17.51 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.472 1.107 . . . . 0.0 111.469 -174.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.478 HG13 ' O ' ' B' ' 72' ' ' GLU . 64.6 mt -123.17 137.11 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.01 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -107.17 103.72 13.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.43 141.49 28.69 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . 0.466 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 33.7 mm -95.27 -48.36 12.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.628 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.495 ' C ' ' H ' ' B' ' 80' ' ' LYS . 9.1 t-20 -155.97 171.94 19.23 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.076 -171.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.15 38.65 1.15 Allowed Glycine 0 C--O 1.228 -0.228 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 176.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . 0.495 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.2 mmtt -130.45 -41.1 1.23 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.46 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.5 OUTLIER -157.95 153.97 27.04 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.205 -175.487 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 49.1 p -125.61 145.42 50.15 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.226 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.0 mm -111.55 100.43 47.89 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.7 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -71.4 142.82 41.74 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.77 2.313 . . . . 0.0 112.036 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.21 142.54 25.08 Favored Pre-proline 0 C--N 1.318 -0.783 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.016 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . 0.414 ' HG2' HD11 ' B' ' 89' ' ' ILE . 24.9 Cg_endo -63.45 139.24 69.72 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.242 1.962 . . . . 0.0 111.281 176.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.542 ' NE ' HD22 ' B' ' 73' ' ' ASN . 8.7 mpt_? -74.31 -3.18 28.68 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.259 -174.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -80.58 -19.35 45.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.524 0.678 . . . . 0.0 109.566 178.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.414 HD11 ' HG2' ' B' ' 86' ' ' PRO . 59.6 mt -104.1 131.48 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.61 -176.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.0 t -84.57 110.23 18.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . 0.545 HG12 ' HH ' ' B' ' 68' ' ' TYR . 1.7 p -120.74 132.44 70.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 121.468 0.652 . . . . 0.0 111.41 -172.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.523 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.81 164.6 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.194 179.144 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . 0.409 ' HB3' ' CG2' ' A' ' 6' ' ' VAL . . . -61.51 -21.28 64.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.692 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.94 -15.81 52.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.042 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.523 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 19.1 t0 -106.81 -21.91 12.88 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.65 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.7 mt -74.79 119.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.267 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.475 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.4 mmmt -113.64 106.42 14.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.065 179.045 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.45 HD13 ' HB ' ' A' ' 8' ' ' ILE . 49.8 mt -109.99 121.75 63.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.174 0.511 . . . . 0.0 111.177 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . 0.475 ' CE1' ' HB3' ' B' ' 97' ' ' LYS . 53.9 m-85 -130.94 124.32 30.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.132 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.563 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 26.9 t-80 -106.38 117.03 32.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.039 0.447 . . . . 0.0 110.578 177.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.535 HD11 ' CE1' ' B' ' 108' ' ' TYR . 69.0 mt -99.58 104.84 16.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 172.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.49 -21.58 48.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.403 -174.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -68.81 -43.68 75.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.016 0.436 . . . . 0.0 110.496 176.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.53 ' H ' HG23 ' B' ' 101' ' ' ILE . 11.1 mm-40 -87.73 -7.17 57.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.284 0.564 . . . . 0.0 110.088 177.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 57.06 35.87 26.93 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.51 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 33.2 m -124.43 138.49 54.35 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.623 -174.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.76 123.05 48.85 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.535 ' CE1' HD11 ' B' ' 101' ' ' ILE . 19.4 m-85 -105.73 129.59 53.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.854 -176.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.522 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.2 mm -117.37 119.62 62.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.858 177.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.45 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.7 m-85 -122.49 122.7 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 176.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.648 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 68.0 mt . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.902 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.421 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 4.2 m . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.992 -0.374 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.5 m -123.52 150.0 27.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.027 0.441 . . . . 0.0 110.721 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.501 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -91.4 139.66 30.51 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.762 179.099 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.433 ' HB ' HD11 ' B' ' 98' ' ' ILE . 6.0 mm -110.42 119.54 46.48 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.137 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.47 128.44 17.24 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.099 1.866 . . . . 0.0 112.207 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.418 HG22 HG21 ' B' ' 98' ' ' ILE . 2.6 p -105.21 135.48 43.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.811 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.536 HG22 ' HA ' ' B' ' 99' ' ' PHE . 0.9 OUTLIER -86.59 150.04 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.044 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.613 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 35.2 mt-10 -116.58 94.77 4.75 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.862 168.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.436 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 16.6 m -114.86 -171.3 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.508 -177.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -103.4 -23.15 13.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.797 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.421 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.6 pt-20 -170.27 161.68 8.33 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.204 176.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.6 150.03 69.18 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.504 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -72.96 174.17 12.39 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.805 2.337 . . . . 0.0 112.142 176.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -59.66 146.09 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.983 0.421 . . . . 0.0 110.503 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.6 -16.36 54.92 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 111.211 -0.755 . . . . 0.0 111.211 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.33 153.41 18.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -110.51 100.88 9.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.114 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 . . . . . 0 C--N 1.319 -0.723 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.124 -179.954 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.422 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 23.2 tt0 . . . . . 0 N--CA 1.443 -0.8 0 CA-C-O 121.533 0.682 . . . . 0.0 109.733 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 94.3 m-85 -85.07 157.05 20.82 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.767 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.442 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 37.7 tt0 -126.34 112.11 15.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.252 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 59.3 t -93.55 128.61 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 O-C-N 123.469 0.481 . . . . 0.0 111.183 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.442 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -129.86 119.53 23.47 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.43 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.506 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -104.35 140.56 37.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.431 -175.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.445 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 2.2 tmtp? -149.26 138.08 21.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 110.696 -174.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.468 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 8.6 mpt_? -98.75 135.84 39.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.201 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.445 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 26.6 m-85 -115.14 143.51 45.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.188 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -127.56 101.92 6.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.336 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.55 32.04 6.17 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.541 -0.837 . . . . 0.0 112.519 178.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.19 172.1 10.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.84 -27.26 63.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.447 0.641 . . . . 0.0 110.531 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.629 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.3 p90 -120.59 143.87 48.41 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.748 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.51 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.7 mppt? -101.82 -22.35 14.38 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.418 -176.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.508 HD13 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.94 132.92 31.12 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.815 -178.423 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -119.75 129.57 54.56 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.508 ' CD1' HD13 ' B' ' 48' ' ' LEU . 2.3 mp -124.7 127.96 73.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.485 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.1 mm? -111.04 121.54 45.62 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . 0.408 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 4.5 mp -126.18 102.67 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 177.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.8 pt-20 -112.34 154.34 25.87 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.12 0.486 . . . . 0.0 110.628 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -99.1 111.35 23.76 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.535 -176.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . 0.466 ' O ' ' HD3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.79 92.57 2.91 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.504 0.669 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.422 ' HB3' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.287 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 120.822 0.344 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -138.8 79.81 26.97 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-O 121.231 0.539 . . . . 0.0 109.745 175.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.458 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 66.8 Cg_endo -77.1 150.81 29.88 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.735 2.29 . . . . 0.0 112.345 -178.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.407 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 17.0 m -153.57 143.63 22.12 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.338 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -104.54 113.4 26.94 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.296 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . 0.468 HD22 ' HB ' ' B' ' 74' ' ' ILE . 0.8 OUTLIER -95.57 108.26 20.5 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.502 177.128 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -60.03 -28.35 67.68 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.19 -44.37 64.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.248 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.513 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.4 mt-10 -114.15 3.38 15.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.996 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 47.8 43.74 17.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.068 0.947 . . . . 0.0 111.453 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.513 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.0 mt -121.93 138.09 53.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.142 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.401 HD11 ' C ' ' B' ' 75' ' ' LEU . 3.5 tm? -100.42 101.68 12.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -89.19 139.48 30.44 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.511 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.8 mm -91.73 -53.23 9.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.499 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.4 p30 -162.48 -165.99 1.28 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.866 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.63 0.59 69.91 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.686 178.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -92.22 -42.4 9.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.413 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -158.63 153.74 25.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.935 -178.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 31.3 t -133.53 150.2 51.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.325 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.4 mm -114.79 105.73 52.88 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.999 0.428 . . . . 0.0 110.95 -174.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.29 136.06 11.12 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.422 2.082 . . . . 0.0 112.599 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.73 146.67 32.25 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.102 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . 0.481 ' HB2' ' OD1' ' B' ' 88' ' ' ASP . 23.3 Cg_endo -62.49 141.7 87.59 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.459 2.106 . . . . 0.0 111.654 176.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -73.88 -7.06 50.85 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.55 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . 0.481 ' OD1' ' HB2' ' B' ' 86' ' ' PRO . 4.6 p-10 -89.29 -4.19 58.23 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.876 0.37 . . . . 0.0 110.781 -178.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.446 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.7 mt -112.29 135.55 51.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.318 179.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -87.21 116.34 29.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.299 0.571 . . . . 0.0 110.19 177.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 54.1 t -121.91 133.56 67.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.293 0.568 . . . . 0.0 111.184 -174.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.447 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.27 159.3 42.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.566 177.915 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.12 -16.67 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.875 -175.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.73 -14.14 49.21 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.025 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.447 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 27.4 t70 -109.31 -22.35 12.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.353 0.597 . . . . 0.0 109.978 -177.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . 0.417 HG23 HG13 ' B' ' 98' ' ' ILE . 85.6 mt -71.4 117.42 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.619 176.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.442 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 26.0 mmmt -112.28 104.7 12.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.677 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . 0.433 HD11 ' HB ' ' A' ' 8' ' ' ILE . 53.5 mt -108.87 117.89 55.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.198 0.523 . . . . 0.0 111.48 -177.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . 0.536 ' HA ' HG22 ' A' ' 11' ' ' VAL . 96.1 m-85 -127.78 121.96 31.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.451 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 t-80 -104.93 123.13 47.22 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 110.173 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.548 HG22 ' H ' ' B' ' 104' ' ' GLU . 52.4 mt -99.05 120.65 48.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.154 0.502 . . . . 0.0 109.846 175.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' B' ' 102' ' ' ARG . 3.9 ptt180 -75.77 -35.91 59.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.756 -176.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.28 -41.27 66.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.101 0.477 . . . . 0.0 110.53 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.548 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.3 tp10 -81.09 -10.9 59.6 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.397 -178.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 30.5 mmm180 58.57 29.49 18.52 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.11 -178.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.412 HG23 ' HB3' ' B' ' 53' ' ' GLU . 85.4 m -127.08 139.77 52.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.59 -168.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.49 120.64 43.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.521 177.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.485 ' CE2' HD11 ' B' ' 51' ' ' LEU . 23.7 m-85 -101.33 125.29 47.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.714 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.451 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.8 mm -113.64 116.39 52.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.114 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.442 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 80.2 m-85 -117.36 124.55 49.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 175.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.629 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.0 mt . . . . . 0 C--O 1.245 0.834 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.592 178.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.452 -0.346 0 CA-C-O 120.733 0.302 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -130.42 142.15 44.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.345 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.93 137.72 32.13 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.684 0.278 . . . . 0.0 110.251 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.5 mm -110.32 120.57 43.87 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -76.81 135.35 15.77 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.243 1.962 . . . . 0.0 112.068 177.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.1 t -85.06 132.93 30.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.605 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.42 HG12 HG11 ' A' ' 13' ' ' VAL . 82.0 t -95.93 112.21 27.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 172.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.499 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 40.7 mt-10 -91.42 110.15 21.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.453 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.42 HG11 HG12 ' A' ' 11' ' ' VAL . 2.5 m -130.31 -176.18 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.662 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -84.09 -30.04 26.3 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -172.78 -178.65 1.92 Allowed 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.158 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.437 HD21 ' HB2' ' A' ' 22' ' ' ARG . 2.4 mm? -77.46 150.83 80.09 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-O 120.808 0.337 . . . . 0.0 110.129 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -65.39 172.63 7.48 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.544 2.163 . . . . 0.0 111.535 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.94 139.67 56.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.354 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.21 -15.38 50.86 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.94 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -84.64 173.29 10.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.762 0.315 . . . . 0.0 110.459 176.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -126.89 100.07 6.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.989 0.423 . . . . 0.0 110.826 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.437 ' HB2' HD21 ' A' ' 16' ' ' LEU . 56.7 ttp85 . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.286 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 . . . . . 0 N--CA 1.445 -0.715 0 CA-C-O 121.348 0.594 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.465 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.0 m-85 -83.35 144.05 29.93 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.13 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -120.54 114.43 21.74 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.486 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 60.4 t -96.96 129.43 47.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.47 -174.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -123.0 136.37 54.83 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.744 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.515 ' HG2' HD12 ' B' ' 48' ' ' LEU . 0.7 OUTLIER -117.1 127.34 54.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.95 0.405 . . . . 0.0 110.922 -179.274 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.577 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 7.3 tmtm? -125.42 118.48 25.96 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -175.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.407 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 6.6 mpt_? -90.09 127.12 36.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.257 0.551 . . . . 0.0 111.52 -172.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.577 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 25.5 m-85 -109.28 167.74 9.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.86 176.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.92 127.17 9.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.465 174.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 74.56 33.75 55.35 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.472 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.17 172.18 10.77 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.768 -0.254 . . . . 0.0 110.401 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.52 -22.96 65.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.293 0.568 . . . . 0.0 110.5 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.618 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -130.83 142.06 50.37 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.958 178.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.517 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.99 -19.21 18.16 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.059 0.457 . . . . 0.0 109.83 -176.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.57 HD13 ' O ' ' B' ' 39' ' ' LYS . 0.0 OUTLIER -143.22 134.74 26.3 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.234 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.438 ' H ' HD13 ' B' ' 48' ' ' LEU . 34.4 ttp180 -113.73 113.0 24.37 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 171.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.1 mp -108.34 127.86 64.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.534 HD12 ' CE2' ' B' ' 108' ' ' TYR . 2.8 mm? -110.12 117.96 35.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.282 -177.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.93 103.71 13.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 16.5 pt-20 -113.23 153.79 27.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.968 0.413 . . . . 0.0 110.543 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . 0.427 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -96.85 112.67 24.32 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.899 -177.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -138.43 91.32 2.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.027 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.659 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.947 172.802 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 . . . . . 0 CA--C 1.509 -0.627 0 CA-C-O 121.665 0.745 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 19.4 t -142.23 78.96 16.36 Favored Pre-proline 0 C--N 1.305 -1.337 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.803 172.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.481 ' C ' ' HG ' ' B' ' 67' ' ' SER . 71.9 Cg_endo -78.65 156.64 28.05 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.937 2.425 . . . . 0.0 112.402 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.481 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 20.3 m -158.51 144.88 17.18 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.229 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.426 ' HB2' HD22 ' B' ' 75' ' ' LEU . 55.7 t80 -106.39 119.04 38.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.583 -177.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.02 113.47 26.08 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.37 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -62.71 -32.09 73.13 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.631 -177.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.62 -50.12 63.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.666 -178.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.533 ' O ' HG13 ' B' ' 74' ' ' ILE . 3.0 mm-40 -103.6 1.6 32.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.391 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 46.97 46.07 15.67 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 124.375 1.047 . . . . 0.0 111.537 -175.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.533 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.7 mt -124.0 138.41 53.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.191 -178.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.426 HD22 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -104.82 102.26 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -88.75 138.6 31.27 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.59 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . 0.407 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 34.9 mm -92.3 -46.53 14.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.084 -175.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -150.26 -179.94 7.61 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.65 1.94 60.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.585 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -101.35 -33.97 9.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.626 -0.287 . . . . 0.0 111.146 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.435 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -154.4 153.32 31.39 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.309 0.576 . . . . 0.0 112.226 178.543 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 33.1 p -129.73 151.78 49.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.178 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mm -111.9 105.01 56.51 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 120.849 0.357 . . . . 0.0 110.514 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -80.34 135.78 10.91 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.632 2.221 . . . . 0.0 112.713 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -103.14 148.26 35.37 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.17 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -66.63 137.73 47.07 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.18 1.92 . . . . 0.0 111.389 175.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.405 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 0.0 OUTLIER -70.5 -3.99 20.62 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.739 -175.832 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.62 -11.58 58.29 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.465 0.65 . . . . 0.0 109.972 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 54.6 mt -107.59 132.04 56.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.534 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 57.8 t -82.91 110.59 18.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 175.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 49.1 t -115.34 132.77 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.67 -174.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.586 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.27 162.2 36.04 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.617 177.481 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.63 -17.82 63.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.89 -175.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.26 -16.41 40.25 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.794 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.586 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 21.0 t0 -104.57 -23.07 13.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.547 0.689 . . . . 0.0 109.672 -176.04 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.44 114.6 13.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.969 177.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.412 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 24.1 mmmt -108.56 105.96 15.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.808 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 48.9 mt -109.38 116.18 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.373 . . . . 0.0 110.856 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . 0.419 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.7 m-85 -129.39 119.83 24.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -177.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.499 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.8 t-80 -102.62 114.2 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.527 HD11 ' CD1' ' B' ' 108' ' ' TYR . 4.2 mp -95.87 101.14 12.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 171.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -78.5 -15.8 58.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.471 -174.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.44 -41.64 80.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.877 0.37 . . . . 0.0 110.152 175.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.473 ' H ' HG21 ' B' ' 101' ' ' ILE . 13.6 mm-40 -94.32 -3.67 50.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.493 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 59.15 35.78 23.79 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.404 -177.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 27.6 m -125.63 134.75 51.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.982 0.42 . . . . 0.0 110.866 -173.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 49.3 tp -108.63 117.49 34.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.232 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.534 ' CE2' HD12 ' B' ' 51' ' ' LEU . 35.7 m-85 -97.78 129.1 44.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.081 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 42.2 mm -116.06 123.1 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.961 176.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.412 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 83.7 m-85 -121.34 127.54 51.38 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.618 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 65.3 mt . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.594 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.3 p . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.61 0.243 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.403 ' CG2' ' HB1' ' B' ' 93' ' ' ALA . 15.2 m -127.45 144.37 37.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.676 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -84.98 138.68 32.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' B' ' 67' ' ' SER . 7.7 mm -107.56 119.85 49.26 Favored Pre-proline 0 C--N 1.321 -0.656 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.119 178.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.38 135.62 24.86 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.557 2.171 . . . . 0.0 112.575 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -93.54 124.23 45.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.566 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.428 ' HB ' ' CD2' ' B' ' 99' ' ' PHE . 58.7 t -92.55 118.47 38.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.421 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.8 mt-10 -94.0 111.02 22.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.379 0.609 . . . . 0.0 110.269 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.74 -175.81 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.107 -177.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.415 ' O ' HG21 ' B' ' 101' ' ' ILE . 27.1 t70 -85.97 -29.75 23.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.506 ' HA ' ' CG1' ' B' ' 101' ' ' ILE . 13.0 pt-20 -178.28 175.26 1.21 Allowed 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.077 173.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.8 mm? -71.88 153.62 92.96 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.788 0.327 . . . . 0.0 111.119 -174.001 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.81 173.04 15.1 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.193 1.929 . . . . 0.0 111.446 174.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.25 138.76 57.87 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.619 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.61 -10.46 41.89 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.831 -175.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -103.92 152.65 21.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.992 0.425 . . . . 0.0 111.598 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -112.91 104.0 11.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.327 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.621 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 63.7 ttp85 . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.159 -176.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 . . . . . 0 N--CA 1.447 -0.62 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.476 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.4 m-85 -87.35 155.98 19.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.927 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -130.21 118.06 20.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.961 175.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -95.96 138.89 20.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.822 -174.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.477 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -132.52 151.75 51.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 175.312 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.49 ' HG2' HD13 ' B' ' 48' ' ' LEU . 2.1 ttt -132.77 141.7 48.64 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 8.7 tmtm? -144.88 135.76 24.74 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.636 -176.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . 0.481 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 7.6 mpt_? -98.61 129.48 45.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.995 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.453 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 31.3 m-85 -107.91 146.9 31.73 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.5 177.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . 0.461 ' HB3' ' HZ1' ' B' ' 42' ' ' LYS . 6.2 ttpm? -129.37 100.11 5.45 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.903 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 93.39 45.19 3.55 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.203 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -133.45 170.74 15.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.78 -17.04 63.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.281 0.562 . . . . 0.0 110.776 177.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.502 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -130.34 140.16 50.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . 0.548 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -95.28 -24.37 16.8 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.226 0.536 . . . . 0.0 109.668 -174.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.507 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.59 136.76 37.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.249 -177.3 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -120.72 129.58 53.7 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.515 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.6 mp -123.03 129.85 74.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.543 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.0 mm? -114.26 118.89 35.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.51 -175.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -124.36 103.53 12.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.1 pt-20 -107.22 153.65 22.38 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.579 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.23 112.46 24.61 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.646 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -136.88 92.82 2.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.37 0.605 . . . . 0.0 110.682 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.589 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.178 176.167 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 . . . . . 0 N--CA 1.451 -0.406 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.7 p -136.38 79.46 42.25 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.169 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.412 ' C ' ' HG ' ' B' ' 67' ' ' SER . 91.4 Cg_endo -87.8 153.86 7.37 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.828 2.352 . . . . 0.0 112.391 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.412 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 24.7 m -157.18 150.29 23.74 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.501 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.416 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 48.8 t80 -109.05 125.45 52.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.507 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -106.54 117.93 35.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -70.17 -14.92 62.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.828 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.13 -50.94 71.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.101 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.511 ' O ' HD13 ' B' ' 74' ' ' ILE . 6.3 mm-40 -113.36 0.1 14.68 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.307 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' B' ' 85' ' ' LEU . 1.8 p-10 51.35 48.28 23.27 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 124.712 1.257 . . . . 0.0 111.014 -171.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.527 HD11 ' HA ' ' B' ' 84' ' ' PRO . 0.3 OUTLIER -107.27 146.97 12.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.736 177.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.402 HD22 ' HB2' ' B' ' 68' ' ' TYR . 3.2 tm? -115.72 102.38 9.68 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -91.07 139.93 30.3 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -178.565 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.0 mm -93.25 -46.42 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.618 -174.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.469 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.2 t-20 -161.93 178.59 8.75 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -175.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.17 32.83 1.31 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.195 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' B' ' 78' ' ' ASN . 28.2 mmmt -125.07 -44.66 1.9 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.509 HD13 ' O ' ' B' ' 81' ' ' LEU . 1.0 OUTLIER -152.25 153.65 34.18 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.784 -177.978 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 13.3 p -126.52 145.82 50.36 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.055 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.6 mm -107.83 111.07 62.55 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.603 -178.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.527 ' HA ' HD11 ' B' ' 74' ' ' ILE . 59.8 Cg_endo -75.69 132.8 14.88 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.992 1.795 . . . . 0.0 111.899 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 78.7 mt -102.6 148.26 35.25 Favored Pre-proline 0 C--N 1.323 -0.561 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.773 -176.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.93 142.93 43.89 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.739 2.293 . . . . 0.0 112.327 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.423 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 9.1 mpt_? -79.07 -6.48 56.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.931 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -79.52 -18.83 51.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.639 0.733 . . . . 0.0 109.714 179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 55.8 mt -107.56 131.5 57.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.773 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.2 115.83 27.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . 0.416 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -126.24 134.85 65.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.324 0.583 . . . . 0.0 111.222 -173.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . 0.426 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.79 164.91 28.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.855 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . 0.403 ' HB1' ' CG2' ' A' ' 6' ' ' VAL . . . -63.77 -16.85 62.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.867 -175.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.48 -12.41 43.08 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.177 0.513 . . . . 0.0 110.905 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . 0.426 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 25.5 t0 -109.24 -26.87 9.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.951 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.5 mt -69.79 114.98 7.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.04 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -108.45 103.42 12.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.401 179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 40.4 mt -107.14 121.51 60.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.796 179.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . 0.428 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 76.3 m-85 -134.56 121.2 20.61 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.275 -178.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.421 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 17.5 t-80 -96.34 110.75 23.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.463 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.696 HD11 ' CD1' ' B' ' 108' ' ' TYR . 3.2 mp -91.87 107.55 18.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 173.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -73.85 -23.19 59.58 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.971 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -60.64 -47.59 85.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.164 0.507 . . . . 0.0 110.643 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.627 ' H ' HG22 ' B' ' 101' ' ' ILE . 15.6 mm-40 -92.61 -3.42 55.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.641 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 57.99 34.39 24.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.128 -176.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 106' ' ' THR . . . . . 0.416 HG22 ' HB3' ' B' ' 53' ' ' GLU . 41.2 m -129.16 141.6 51.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.201 -170.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.8 tp -107.12 120.31 41.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.007 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.696 ' CD1' HD11 ' B' ' 101' ' ' ILE . 21.2 m-85 -102.6 130.61 49.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.014 -178.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.515 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.5 mm -115.49 120.23 64.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.9 177.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.423 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.7 m-85 -121.01 126.66 50.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.502 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.646 -0.692 . . . . 0.0 109.82 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.4 m -135.33 152.87 32.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.705 0.288 . . . . 0.0 110.647 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.423 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.4 OUTLIER -96.76 138.38 34.41 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.753 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.6 mm -111.86 121.26 40.15 Favored Pre-proline 0 C--N 1.323 -0.565 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.311 -177.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.64 130.34 18.09 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.05 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 p -100.77 127.1 54.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.188 0.518 . . . . 0.0 110.667 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.469 HG12 HG11 ' A' ' 13' ' ' VAL . 83.0 t -95.5 123.07 47.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.128 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.458 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.2 mt-10 -92.19 109.69 21.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.479 0.657 . . . . 0.0 110.514 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.469 HG11 HG12 ' A' ' 11' ' ' VAL . 3.5 m -126.22 -176.12 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.423 -176.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -91.27 -25.64 19.38 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.429 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.5 pt-20 -171.51 170.54 5.75 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.75 176.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.409 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.1 mm? -74.1 151.63 88.26 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.521 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -59.41 171.54 2.44 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.374 2.049 . . . . 0.0 111.81 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.74 130.67 42.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.044 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.86 -6.33 29.32 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.375 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.76 164.45 14.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.923 0.392 . . . . 0.0 111.363 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -115.83 97.36 6.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.363 -177.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.499 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 35.1 ttp85 . . . . . 0 C--N 1.322 -0.591 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.424 -175.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . 0.51 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 23.8 tt0 . . . . . 0 N--CA 1.45 -0.467 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.449 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 77.4 m-85 -88.09 142.71 27.56 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.297 176.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -122.58 112.03 17.5 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.43 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 56.9 t -96.93 136.67 26.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.027 -171.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -132.52 132.62 42.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' MET . . . . . 0.524 ' HG2' HD13 ' B' ' 48' ' ' LEU . 2.1 ttt -113.57 138.82 49.61 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.473 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . 0.523 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 9.8 tmtm? -143.49 136.63 27.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.948 0.404 . . . . 0.0 110.706 -176.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -100.95 135.94 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.825 -177.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' PHE . . . . . 0.523 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.6 m-85 -111.83 155.73 23.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.987 0.422 . . . . 0.0 110.709 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -127.21 119.25 25.97 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.968 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 63.41 46.98 91.4 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.415 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -126.57 171.04 11.44 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.58 -2.74 18.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.96 0.409 . . . . 0.0 111.101 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' TYR . . . . . 0.505 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.2 OUTLIER -150.06 128.15 11.95 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.913 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -84.49 -28.54 26.69 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.216 -173.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.582 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -133.59 135.78 44.49 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.65 -178.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -121.39 125.28 46.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.527 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' ILE . . . . . 0.582 ' CD1' HD12 ' B' ' 48' ' ' LEU . 1.8 mp -122.26 129.47 75.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.617 HD12 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -111.99 114.88 28.03 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.633 -178.119 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.18 104.53 14.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.449 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 14.9 pt-20 -108.41 153.08 23.8 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.339 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' ASN . . . . . 0.431 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -97.3 110.33 22.9 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.528 -179.343 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -137.32 91.59 2.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.086 0.47 . . . . 0.0 110.815 178.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' ALA . . . . . 0.51 ' HB3' ' H ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.321 -0.639 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.534 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 . . . . . 0 N--CA 1.449 -0.515 0 CA-C-O 120.805 0.336 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 10.9 m -135.33 78.97 50.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' PRO . . . . . 0.467 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.3 Cg_endo -77.19 149.18 27.95 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.312 2.008 . . . . 0.0 112.088 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.437 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 14.7 m -154.28 141.89 19.86 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.239 -179.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . 0.429 ' HB2' HD23 ' B' ' 75' ' ' LEU . 43.1 t80 -105.74 113.06 26.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.311 -178.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -95.63 106.1 18.16 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 176.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -56.42 -34.07 66.42 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.335 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.72 -45.21 58.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.859 -176.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . 0.524 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.0 mt-10 -112.31 5.31 18.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.096 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . 0.415 HD22 ' NE ' ' B' ' 87' ' ' ARG . 2.6 p-10 48.86 42.31 19.99 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.755 1.284 . . . . 0.0 111.6 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.524 HG13 ' O ' ' B' ' 72' ' ' GLU . 65.7 mt -118.75 135.77 58.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.168 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . 0.429 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -103.67 102.99 12.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.467 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -89.75 141.47 28.59 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -178.737 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 43.2 mm -97.97 -45.75 12.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.863 -176.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -156.53 176.48 12.65 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.013 -172.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.14 2.4 44.02 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -89.22 -43.94 10.63 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' LEU . . . . . 0.51 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.7 OUTLIER -157.0 153.46 28.03 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.495 0.664 . . . . 0.0 112.495 -176.258 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 15.8 p -124.28 146.91 48.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.812 176.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -108.18 102.35 45.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 120.888 0.375 . . . . 0.0 110.774 -177.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.477 ' HA ' HG12 ' B' ' 74' ' ' ILE . 60.5 Cg_endo -75.81 126.09 9.22 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.213 1.942 . . . . 0.0 112.127 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 83.5 mt -92.63 154.92 42.38 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.465 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -68.53 138.49 42.15 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 111.877 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' ARG . . . . . 0.424 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 9.1 mpt_? -80.69 -0.2 37.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -87.68 -10.35 51.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.386 0.612 . . . . 0.0 110.362 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' ILE . . . . . 0.49 ' CD1' HD22 ' B' ' 48' ' ' LEU . 57.4 mt -112.47 137.77 44.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.196 -175.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 64.6 t -83.19 111.73 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.917 177.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 92.7 t -118.69 131.32 71.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.597 0.713 . . . . 0.0 111.652 -174.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.35 159.89 41.34 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.228 176.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.64 -14.79 59.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.12 0.486 . . . . 0.0 111.55 -177.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.12 -26.19 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.077 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.38 -26.27 14.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.991 0.424 . . . . 0.0 110.582 -178.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 89.6 mt -69.0 113.4 4.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.764 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -110.41 108.15 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.875 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 50.7 mt -111.92 116.39 52.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.85 0.357 . . . . 0.0 110.861 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -128.62 119.09 24.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.471 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 100' ' ' HIS . . . . . 0.458 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 13.1 t-80 -98.07 110.21 22.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.575 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 101' ' ' ILE . . . . . 0.541 HG22 ' H ' ' B' ' 104' ' ' GLU . 61.1 mt -91.28 104.57 15.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.649 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . 0.448 ' HG2' ' CE1' ' B' ' 100' ' ' HIS . 20.7 mtm180 -76.12 -28.24 57.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.895 -177.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -59.9 -42.16 93.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.798 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.541 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.0 tp10 -99.05 -0.93 40.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.174 -177.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 58.61 30.24 19.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.788 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 28.0 m -127.99 139.22 52.69 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.016 0.436 . . . . 0.0 111.155 -172.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.8 tp -109.05 120.23 41.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.296 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 108' ' ' TYR . . . . . 0.617 ' CE2' HD12 ' B' ' 51' ' ' LEU . 31.5 m-85 -102.08 127.0 49.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 109' ' ' ILE . . . . . 0.439 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 32.6 mm -113.87 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.798 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 110' ' ' TYR . . . . . 0.467 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.0 m-85 -122.32 126.5 48.22 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 111' ' ' ILE . . . . . 0.505 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 55.4 mt . . . . . 0 C--O 1.245 0.865 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.309 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.12 70.44 7.12 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 123.188 2.592 . . . . 0.0 111.873 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -79.92 72.29 6.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.348 0.594 . . . . 0.0 110.71 -177.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 50.0 ttm -122.96 126.74 47.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.929 175.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 1.5 m -140.67 132.76 27.9 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.563 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -119.57 143.1 32.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 120.829 0.347 . . . . 0.0 110.795 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.41 137.4 33.41 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.4 mm -105.41 121.05 47.49 Favored Pre-proline 0 C--N 1.319 -0.747 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.101 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.86 125.71 12.96 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.196 1.931 . . . . 0.0 111.956 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 p -103.31 127.98 56.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.551 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.446 HG11 HG13 ' A' ' 13' ' ' VAL . 44.2 t -95.04 125.17 47.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.816 178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.435 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 35.3 mt-10 -93.25 96.05 9.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.637 0.732 . . . . 0.0 110.428 178.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 5.0 m -107.27 177.49 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.208 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.09 -14.02 24.61 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -178.61 166.83 1.77 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.596 -1.183 . . . . 0.0 109.677 173.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 22' ' ' ARG . 1.1 mm? -73.73 149.6 88.21 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.532 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.03 168.18 21.35 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.432 2.088 . . . . 0.0 111.516 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.23 140.22 57.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -24.31 18.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.688 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -86.06 164.32 17.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.016 0.436 . . . . 0.0 111.087 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.59 95.49 5.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.645 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.486 ' HB2' HD21 ' A' ' 16' ' ' LEU . 33.4 ttt-85 -101.18 147.38 26.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.0 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 m . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.651 -0.69 . . . . 0.0 109.656 179.857 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.478 0.602 0 N-CA-C 110.623 -0.568 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -127.73 -44.74 1.49 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.833 0.349 . . . . 0.0 110.636 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -144.11 34.02 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.134 0.492 . . . . 0.0 110.765 -177.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 mp0 -97.45 145.93 25.71 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.587 177.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -132.2 153.65 50.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.482 0.658 . . . . 0.0 111.551 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -129.83 -12.01 4.29 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.787 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.95 -10.56 59.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.486 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 98.3 t -68.05 122.29 83.37 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.201 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -69.89 130.03 18.48 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.599 2.199 . . . . 0.0 112.083 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -113.41 99.05 7.48 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.126 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 83.5 m-85 -89.86 152.82 21.07 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -129.65 119.05 22.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 51.9 t -97.48 132.12 42.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.533 -175.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.416 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -125.88 132.91 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 176.187 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.7 ttt -118.14 139.34 51.4 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.505 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.492 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.3 tmtp? -144.9 132.73 21.19 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.309 -175.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.456 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -94.3 134.12 37.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.265 -176.55 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.492 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.9 m-85 -121.55 134.98 55.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.804 179.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -116.22 118.82 33.85 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.499 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.21 19.76 62.0 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.386 175.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -108.62 172.07 7.06 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 122.709 -0.289 . . . . 0.0 110.492 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.82 -20.37 63.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.343 0.592 . . . . 0.0 110.434 176.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.58 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -128.87 141.57 51.24 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.561 177.73 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.521 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -98.05 -21.45 16.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.229 0.537 . . . . 0.0 109.622 -176.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.535 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.09 132.83 29.02 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.235 -179.176 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.41 ' N ' HD12 ' B' ' 48' ' ' LEU . 31.9 ttp180 -114.71 121.23 42.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.4 mp -118.52 128.54 75.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.538 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.3 mm? -114.98 121.09 42.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.442 -177.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -125.31 104.25 13.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.8 pt-20 -107.06 153.36 22.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.982 0.42 . . . . 0.0 110.614 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.14 107.41 19.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.129 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -130.05 93.78 3.57 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.458 0.647 . . . . 0.0 110.346 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.487 ' HB2' ' HD2' ' B' ' 57' ' ' PRO . . . -137.29 167.32 21.29 Favored Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.505 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.571 ' C ' HD21 ' B' ' 58' ' ' ASN . 9.8 Cg_endo -52.3 -49.66 16.65 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.089 1.86 . . . . 0.0 110.703 176.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . 0.571 HD21 ' C ' ' B' ' 57' ' ' PRO . 1.0 OUTLIER -126.16 -75.62 0.59 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.623 177.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.474 ' HB2' ' HB3' ' B' ' 56' ' ' ALA . 38.9 t 68.45 138.56 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.348 -176.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.515 ' O ' ' HG3' ' B' ' 60' ' ' LYS . 13.9 ptmm? -129.95 74.94 80.15 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.695 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -69.7 141.87 46.65 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 121.954 1.769 . . . . 0.0 111.341 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -108.56 -69.78 0.84 Allowed 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.133 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.448 ' H ' ' HD2' ' B' ' 63' ' ' ARG . 0.0 OUTLIER -127.16 166.22 18.1 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.083 0.468 . . . . 0.0 110.898 -177.792 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -127.08 111.1 13.64 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.418 173.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 16.0 m -129.95 79.89 72.25 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-O 121.153 0.502 . . . . 0.0 109.778 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.437 ' C ' ' HG ' ' B' ' 67' ' ' SER . 63.9 Cg_endo -79.68 150.41 21.49 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 111.784 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.502 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 14.1 m -154.03 142.38 20.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.491 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.428 ' HH ' HG12 ' B' ' 91' ' ' VAL . 59.7 t80 -104.56 118.47 36.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.493 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.443 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.0 OUTLIER -100.05 115.27 29.35 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.748 177.119 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -64.25 -28.2 69.57 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.506 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.75 -46.63 70.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.407 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.504 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -112.46 2.44 16.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.568 -177.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . 0.419 HD22 ' NE ' ' B' ' 87' ' ' ARG . 2.1 p-10 48.37 45.56 20.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.38 1.072 . . . . 0.0 111.822 -175.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.504 HG13 ' O ' ' B' ' 72' ' ' GLU . 66.9 mt -124.07 137.95 55.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.152 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -102.9 104.21 14.43 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.502 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.5 p90 -93.07 142.1 27.67 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.84 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.1 mm -88.24 -54.02 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 -177.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 41.3 m-20 -153.25 176.91 11.43 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.3 40.63 1.75 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.56 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . 0.645 ' HD3' ' O ' ' B' ' 80' ' ' LYS . 0.0 OUTLIER -131.23 -36.53 1.3 Allowed 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.474 ' HG ' ' HG3' ' B' ' 80' ' ' LYS . 0.2 OUTLIER -154.53 153.53 31.61 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.441 0.638 . . . . 0.0 111.704 175.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 21.2 p -130.47 148.99 52.34 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.274 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mm -107.84 102.53 45.79 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 120.819 0.342 . . . . 0.0 110.178 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.85 135.13 17.2 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.208 1.939 . . . . 0.0 112.117 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -97.59 141.09 22.47 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.559 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -64.76 139.62 63.77 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.986 1.791 . . . . 0.0 110.761 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.419 ' NE ' HD22 ' B' ' 73' ' ' ASN . 9.6 mpt_? -70.82 -0.99 10.2 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.789 -174.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -79.28 -16.79 55.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.534 0.683 . . . . 0.0 109.714 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -110.04 137.1 43.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.6 p -92.32 112.37 25.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . 0.428 HG12 ' HH ' ' B' ' 68' ' ' TYR . 2.5 p -121.38 139.32 48.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.306 0.574 . . . . 0.0 111.218 -174.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.56 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.5 164.69 29.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.011 -178.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.83 -23.53 63.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.058 0.456 . . . . 0.0 111.577 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.06 -16.48 43.63 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.279 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.56 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.7 t70 -102.51 -24.27 13.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.683 0.754 . . . . 0.0 109.563 -176.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . 0.419 HG23 HG13 ' B' ' 98' ' ' ILE . 81.3 mt -72.78 115.55 13.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.306 177.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -109.47 106.49 16.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.718 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.419 HG13 HG23 ' B' ' 96' ' ' ILE . 57.2 mt -110.99 121.14 63.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.447 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -134.54 124.43 25.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.367 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.435 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 22.5 t-80 -105.5 113.09 26.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.715 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.58 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 3.0 mp -89.37 118.39 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 175.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 62.8 mtp85 -81.76 -23.71 36.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.866 -177.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -57.94 -43.33 86.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.14 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.486 ' H ' HG23 ' B' ' 101' ' ' ILE . 11.0 pt-20 -110.0 0.98 18.72 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.456 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 58.27 38.49 26.08 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.63 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.426 HG21 ' HB3' ' B' ' 53' ' ' GLU . 29.1 m -117.73 137.92 52.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 120.921 0.391 . . . . 0.0 110.674 -176.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.25 114.35 28.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.875 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.538 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.2 m-85 -93.48 125.44 38.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.377 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 44.0 mm -115.04 121.95 68.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.109 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.44 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.0 m-85 -121.8 127.83 51.02 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.58 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.3 mt . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.783 -0.627 . . . . 0.0 109.767 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.05 56.07 5.26 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.01 2.473 . . . . 0.0 113.126 -177.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.472 ' O ' ' HB3' ' A' ' 4' ' ' MET . 3.4 t-160 -162.65 -78.09 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 176.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.472 ' HB3' ' O ' ' A' ' 3' ' ' HIS . 22.3 ptp 172.0 158.35 0.09 Allowed 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.748 0.655 . . . . 0.0 109.325 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.0 p -136.37 128.1 29.04 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.701 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.3 m -122.51 141.01 44.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.748 -176.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.412 ' HA ' ' CB ' ' B' ' 67' ' ' SER . 0.3 OUTLIER -88.19 138.03 31.81 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.061 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.435 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.0 mm -107.59 120.92 45.87 Favored Pre-proline 0 C--N 1.317 -0.827 0 C-N-CA 120.634 -0.427 . . . . 0.0 109.887 -176.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.12 130.63 21.84 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.503 2.135 . . . . 0.0 112.469 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.9 t -89.67 131.84 35.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.645 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.435 ' HB ' ' CD2' ' B' ' 99' ' ' PHE . 47.6 t -97.48 111.22 26.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 172.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.5 mt-10 -92.64 107.19 19.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.629 0.728 . . . . 0.0 110.789 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.4 m -135.43 -174.33 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.299 -177.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.512 ' OD1' ' HB2' ' B' ' 103' ' ' LYS . 24.5 m-20 -105.61 -10.07 17.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.887 0.375 . . . . 0.0 110.547 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -165.19 156.28 14.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.687 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.432 HD23 ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -84.77 156.2 61.45 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.702 0.287 . . . . 0.0 110.722 -179.1 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -54.88 170.55 0.61 Allowed 'Trans proline' 0 C--O 1.238 0.501 0 C-N-CA 123.464 2.776 . . . . 0.0 113.161 172.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.24 142.22 58.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.397 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.56 -9.7 66.7 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.24 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -88.11 147.1 25.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.274 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -101.38 102.89 13.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.434 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.432 ' HD2' HD23 ' A' ' 16' ' ' LEU . 14.5 ttt180 -104.67 143.92 32.42 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.049 -172.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.1 m . . . . . 0 C--O 1.251 1.136 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.276 176.454 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.479 0.649 0 CA-C-O 120.776 0.24 . . . . 0.0 111.754 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -142.44 45.25 1.63 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -92.55 -153.27 0.34 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.688 -170.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -71.5 174.11 7.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.08 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -76.9 157.42 31.39 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.741 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -108.78 -11.78 15.0 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.018 -177.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -82.76 -4.56 58.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.979 -179.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.5 t -55.85 112.58 4.46 Favored Pre-proline 0 C--N 1.329 -0.306 0 O-C-N 123.878 0.736 . . . . 0.0 112.178 -171.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.68 130.04 8.55 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.839 2.359 . . . . 0.0 111.64 174.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.508 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 34.1 tt0 -88.58 95.13 10.12 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.381 0.61 . . . . 0.0 109.766 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.6 m-85 -84.28 154.48 22.95 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.529 176.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -123.59 113.7 19.04 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -95.45 131.43 42.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.984 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.55 142.95 51.24 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.523 ' HG2' HD13 ' B' ' 48' ' ' LEU . 1.5 ttt -124.26 140.64 52.77 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.015 -0.274 . . . . 0.0 110.582 -176.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.465 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.9 tmtp? -145.3 133.82 22.0 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.704 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.465 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.92 137.49 34.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.713 179.366 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -117.54 150.67 38.58 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -125.27 111.17 14.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.958 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.59 54.52 6.62 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.584 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.81 171.45 14.48 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 174.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.78 66.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.687 0.756 . . . . 0.0 110.206 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.661 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -124.84 135.56 53.03 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.923 -178.756 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.523 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.5 mppt? -96.07 -23.53 16.75 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.523 HD13 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -136.66 130.3 31.97 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.735 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -118.63 123.46 45.04 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.836 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.512 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.3 mp -120.04 130.85 73.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.482 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.73 119.95 38.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -123.74 103.48 12.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -108.86 153.7 23.15 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.693 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . 0.4 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -100.52 114.43 28.05 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.501 -178.866 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.567 ' O ' ' HD3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -137.61 90.95 2.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.664 0.745 . . . . 0.0 111.318 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.509 ' HB2' ' HB3' ' B' ' 59' ' ' SER . . . -137.65 153.27 74.0 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.63 177.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.531 ' HG2' ' ND2' ' B' ' 58' ' ' ASN . 37.4 Cg_endo -69.29 -3.84 12.51 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.859 2.373 . . . . 0.0 112.684 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . 0.531 ' ND2' ' HG2' ' B' ' 57' ' ' PRO . 0.2 OUTLIER -136.79 -81.55 0.38 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.635 179.164 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.509 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 11.3 p 50.87 113.22 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.615 1.166 . . . . 0.0 113.863 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -120.11 74.59 21.25 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.113 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -66.69 145.49 75.78 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.71 2.273 . . . . 0.0 111.99 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -98.82 -61.86 1.31 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.019 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -164.48 172.81 12.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.827 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -117.12 116.2 26.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.727 0.298 . . . . 0.0 110.451 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 11.5 t -135.61 79.86 46.08 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.67 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.411 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 66.2 Cg_endo -87.9 160.43 7.47 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.068 2.512 . . . . 0.0 113.168 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.412 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 38.8 p -161.96 144.44 11.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.731 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -103.47 119.58 39.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.787 -177.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -100.58 116.06 31.63 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.503 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -66.98 -24.91 66.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.891 -176.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.01 -43.26 86.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.708 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.462 ' O ' HG13 ' B' ' 74' ' ' ILE . 10.3 mt-10 -112.45 4.76 17.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 48.24 43.14 18.67 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 124.524 1.14 . . . . 0.0 111.067 -176.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.462 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.5 mt -119.25 134.67 62.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.269 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -102.92 103.34 13.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 176.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -88.8 144.91 25.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -178.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . 0.411 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 42.5 mm -98.51 -57.45 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.155 0.502 . . . . 0.0 110.927 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.4 ' C ' ' H ' ' B' ' 80' ' ' LYS . 16.2 m-20 -147.07 179.06 7.89 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.22 4.76 10.72 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.286 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' B' ' 78' ' ' ASN . 72.2 mmtt -93.86 -45.1 7.79 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.487 ' O ' HD11 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -151.8 153.23 33.85 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.557 0.694 . . . . 0.0 112.452 -177.464 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 10.6 p -126.47 147.43 49.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.891 176.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 52.1 mm -106.83 109.12 62.93 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.936 0.398 . . . . 0.0 110.751 -177.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.454 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.9 Cg_endo -81.49 137.15 10.18 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.262 1.974 . . . . 0.0 112.024 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.91 150.18 36.83 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.949 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.22 142.15 85.26 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.537 2.158 . . . . 0.0 111.552 176.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -79.19 -2.83 42.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.069 -176.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.33 2.33 56.7 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.786 0.327 . . . . 0.0 111.083 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 58.1 mt -121.95 138.28 52.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.506 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.26 122.91 38.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 52.3 t -126.14 130.16 72.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.207 0.527 . . . . 0.0 111.299 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.597 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.31 161.44 37.89 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.725 177.427 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.45 -12.6 54.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.201 -175.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.62 -9.23 47.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.213 0.53 . . . . 0.0 110.882 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.597 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 12.7 t70 -111.75 -24.82 9.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.673 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.3 mt -73.08 115.06 13.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.949 176.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.437 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.9 mmmm -111.35 101.92 10.35 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.949 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.435 HD12 ' HB ' ' A' ' 8' ' ' ILE . 32.8 mt -101.85 122.6 54.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 111.343 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . 0.435 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 70.7 m-85 -133.21 118.13 18.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.252 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.475 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 20.2 t-80 -100.4 107.78 19.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.821 0.343 . . . . 0.0 110.495 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.618 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 49.8 mt -86.85 102.56 12.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.18 0.514 . . . . 0.0 110.021 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -17.34 63.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.658 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . 0.512 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 30.8 tttm -67.19 -48.91 66.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.998 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.487 ' H ' HG23 ' B' ' 101' ' ' ILE . 9.4 mm-40 -101.32 4.93 42.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.159 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? 55.28 37.08 28.36 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.652 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 40.0 m -125.25 130.6 52.39 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.066 -174.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.54 117.69 33.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.629 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.587 ' CE1' HD12 ' B' ' 101' ' ' ILE . 10.1 m-85 -95.99 124.39 39.98 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.113 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.512 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.1 mm -114.81 115.92 50.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.869 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.487 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.3 m-85 -116.4 125.11 51.58 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 176.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.661 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 58.7 mt . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.94 -0.552 . . . . 0.0 109.741 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.62 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.72 120.5 8.35 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 122.542 2.161 . . . . 0.0 111.279 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -77.8 65.75 3.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.719 0.771 . . . . 0.0 111.094 -175.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 59.5 ttp -133.43 136.34 45.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.784 -1.098 . . . . 0.0 108.877 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 m -134.65 144.22 47.72 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.7 m -130.81 145.89 34.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.941 0.4 . . . . 0.0 110.891 -177.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 136.15 33.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.899 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.416 ' HB ' HD11 ' B' ' 98' ' ' ILE . 6.5 mm -105.19 121.08 47.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.309 -178.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.03 130.53 15.58 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.433 2.089 . . . . 0.0 112.26 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 46.4 t -86.95 133.3 30.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.576 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.47 HG11 HG12 ' A' ' 13' ' ' VAL . 98.9 t -98.01 119.94 46.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 173.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -93.18 111.99 23.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.566 0.698 . . . . 0.0 110.697 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.47 HG12 HG11 ' A' ' 11' ' ' VAL . 4.8 m -129.6 170.46 18.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.535 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -91.61 -20.24 21.86 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -168.76 155.9 7.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.12 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.422 HD23 ' HD2' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -78.7 149.32 74.3 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -67.56 172.23 10.71 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.328 2.019 . . . . 0.0 111.44 177.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.74 135.86 57.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.163 0.506 . . . . 0.0 111.439 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.0 -17.26 27.31 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.793 -175.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -94.06 146.73 23.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.939 0.4 . . . . 0.0 111.074 178.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -101.27 95.22 6.38 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.103 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.422 ' HD2' HD23 ' A' ' 16' ' ' LEU . 18.3 ttt180 -90.84 146.48 23.9 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.841 -178.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.305 -0.855 . . . . 0.0 109.341 177.248 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.479 0.666 0 N-CA-C 110.547 -0.597 . . . . 0.0 110.547 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 42.4 m80 69.53 -52.91 0.61 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.578 0.751 . . . . 0.0 111.697 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -58.39 121.18 10.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.817 0.341 . . . . 0.0 110.568 178.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -131.17 147.35 52.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.683 176.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -82.71 155.0 24.54 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.149 0.5 . . . . 0.0 110.772 -177.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.14 -29.81 11.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.322 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -92.28 26.17 2.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.031 176.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.0 p -69.74 123.05 87.81 Favored Pre-proline 0 N--CA 1.448 -0.533 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.69 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.483 ' HA ' ' CB ' ' B' ' 59' ' ' SER . 20.0 Cg_endo -64.89 130.06 24.98 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.756 2.304 . . . . 0.0 112.598 -178.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -104.03 102.85 12.61 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.536 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 92.5 m-85 -90.47 142.03 28.15 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.692 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.428 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 35.2 tt0 -112.4 107.15 15.84 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.6 p -94.91 127.26 47.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.261 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.428 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -124.26 121.44 35.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.514 ' HG2' HD13 ' B' ' 48' ' ' LEU . 2.5 ttt -107.65 139.11 42.7 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 -175.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.532 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 8.4 tmtm? -144.54 134.87 24.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.853 0.358 . . . . 0.0 110.515 -174.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.5 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -94.76 134.17 37.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -178.808 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.532 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 34.5 m-85 -119.15 139.4 51.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.985 0.422 . . . . 0.0 111.128 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -130.41 116.29 18.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.597 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 90.82 32.27 9.29 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.95 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.79 170.85 13.35 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.43 64.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.401 0.619 . . . . 0.0 110.448 177.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.537 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.3 p90 -126.97 147.58 50.11 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.795 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.521 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -104.57 -18.62 14.27 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.24 0.543 . . . . 0.0 109.742 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.536 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.83 133.34 31.9 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.398 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -119.77 131.12 55.26 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.536 ' CD1' HD12 ' B' ' 48' ' ' LEU . 1.9 mp -128.19 128.45 68.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.568 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.9 mm? -111.55 119.92 40.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.1 mp -126.88 104.07 12.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.536 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -111.43 153.76 25.65 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.942 0.401 . . . . 0.0 110.55 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.06 100.32 11.46 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.488 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -129.28 93.5 3.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.6 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.535 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -134.83 158.2 75.5 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.106 176.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -60.68 -41.63 45.51 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.492 2.128 . . . . 0.0 110.559 172.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -138.56 97.43 3.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.073 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.535 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 11.9 p -134.32 134.3 41.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.512 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -128.13 77.28 76.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.887 177.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.75 144.88 67.26 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 122.421 2.081 . . . . 0.0 111.744 176.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -85.59 -63.85 1.25 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.19 -178.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -164.91 177.45 7.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.495 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -114.57 117.95 32.36 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.546 176.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.3 m -133.02 79.21 63.42 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 176.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.466 ' C ' ' HG ' ' B' ' 67' ' ' SER . 89.7 Cg_endo -83.29 153.38 14.07 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.78 2.32 . . . . 0.0 112.436 -178.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.466 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 14.2 m -156.65 145.95 20.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.213 -178.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.422 ' HB2' HD22 ' B' ' 75' ' ' LEU . 49.8 t80 -108.34 124.42 50.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.599 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -105.28 116.71 32.41 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.646 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -66.7 -25.89 66.76 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.687 -176.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.8 -50.99 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.547 -178.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.531 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.9 mt-10 -112.68 7.56 18.71 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.486 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 50.66 42.73 27.51 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 124.268 0.98 . . . . 0.0 111.429 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.531 HG13 ' O ' ' B' ' 72' ' ' GLU . 68.1 mt -117.75 138.07 49.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.457 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.434 HD13 ' C ' ' B' ' 75' ' ' LEU . 3.4 tm? -105.03 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.49 140.17 29.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.7 mm -92.85 -57.06 4.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.958 -176.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.452 ' C ' ' H ' ' B' ' 80' ' ' LYS . 57.8 m-20 -151.95 -177.81 6.37 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -178.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.19 20.93 2.94 Favored Glycine 0 C--O 1.225 -0.409 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.964 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . 0.452 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.7 mmtt -110.62 -38.36 5.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.473 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.8 OUTLIER -160.47 153.36 21.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.876 178.052 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.2 t -127.92 150.37 49.91 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.584 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mm -114.81 100.81 53.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.952 0.405 . . . . 0.0 111.045 -175.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.442 ' HA ' HG12 ' B' ' 74' ' ' ILE . 21.4 Cg_exo -67.92 136.55 38.67 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.712 2.275 . . . . 0.0 112.33 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 63.6 mt -103.65 153.82 38.37 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.092 -178.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.33 138.69 30.63 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.125 1.883 . . . . 0.0 111.787 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.408 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 1.8 mmt180 -74.9 2.18 10.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.804 -177.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -86.91 -18.41 30.88 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.415 0.626 . . . . 0.0 110.053 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 66.7 mt -104.38 134.01 46.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.303 -176.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 48.3 t -82.46 111.57 19.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.85 130.93 73.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.324 0.583 . . . . 0.0 111.461 -172.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.553 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.82 163.36 33.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.358 175.137 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.21 -19.01 64.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.913 0.387 . . . . 0.0 111.799 -177.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.3 -13.3 55.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.961 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.553 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 23.3 t0 -109.04 -20.69 12.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.573 0.701 . . . . 0.0 109.881 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . 0.405 HG22 HG13 ' B' ' 98' ' ' ILE . 80.3 mt -76.73 116.27 19.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.786 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.456 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.5 mmmt -109.62 104.07 13.03 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.254 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.416 HD11 ' HB ' ' A' ' 8' ' ' ILE . 49.1 mt -107.82 121.38 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -130.71 121.12 24.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.257 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -104.5 114.76 29.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.898 0.38 . . . . 0.0 110.597 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.459 HG23 ' H ' ' B' ' 104' ' ' GLU . 58.7 mt -90.96 100.55 11.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -69.69 -24.48 63.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.148 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -59.23 -47.92 83.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.321 0.581 . . . . 0.0 110.494 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.459 ' H ' HG23 ' B' ' 101' ' ' ILE . 13.7 mm-40 -100.88 0.79 39.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.819 -175.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 57.1 33.5 23.42 Favored 'General case' 0 N--CA 1.46 0.072 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.66 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.413 ' CG2' HD13 ' B' ' 51' ' ' LEU . 46.1 m -119.62 130.13 54.95 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -174.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.27 121.27 41.94 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.03 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.568 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.7 m-85 -98.97 126.79 44.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.155 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.448 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.3 mm -115.36 121.4 67.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.899 175.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.456 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 82.2 m-85 -122.55 124.32 43.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.537 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.819 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.901 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 112.178 -0.369 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -71.77 141.28 37.12 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.918 2.412 . . . . 0.0 111.523 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.414 ' HA ' ' HB3' ' B' ' 71' ' ' ALA . 2.2 p80 -102.13 54.61 0.8 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.397 0.618 . . . . 0.0 110.555 -177.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 54.9 tpp -55.65 124.68 18.18 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.088 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.3 p -147.46 135.37 21.23 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.406 -174.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -125.84 142.63 41.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.324 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.496 ' HA ' ' CB ' ' B' ' 67' ' ' SER . 0.5 OUTLIER -91.5 140.05 30.12 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.352 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.5 mm -110.35 123.52 35.67 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 -176.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -71.39 125.51 11.35 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.077 1.851 . . . . 0.0 111.979 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.406 HG21 HG21 ' B' ' 98' ' ' ILE . 1.9 p -97.65 119.96 46.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.482 HG11 HG12 ' A' ' 13' ' ' VAL . 61.5 t -91.29 117.13 33.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -84.72 111.91 20.01 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.325 0.583 . . . . 0.0 110.271 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.482 HG12 HG11 ' A' ' 11' ' ' VAL . 3.3 m -124.55 -174.77 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.58 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -93.73 -26.77 16.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -171.14 167.19 7.16 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.344 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.432 HD22 ' HB2' ' A' ' 22' ' ' ARG . 2.3 mm? -71.04 143.49 88.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.636 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.92 174.48 11.15 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.928 2.419 . . . . 0.0 112.259 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.85 139.77 12.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.459 178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.16 -9.42 57.85 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.429 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -102.86 167.52 9.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.991 0.424 . . . . 0.0 111.953 -179.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -127.53 98.92 5.39 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.575 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.432 ' HB2' HD22 ' A' ' 16' ' ' LEU . 26.5 ttp85 -93.92 140.1 30.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.4 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.2 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.76 -0.638 . . . . 0.0 110.082 -177.024 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.471 0.178 0 N-CA-C 111.29 -0.311 . . . . 0.0 111.29 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -122.93 71.53 1.05 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.0 0.429 . . . . 0.0 110.534 177.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -140.34 147.61 40.09 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.893 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -77.91 145.43 36.16 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -142.11 162.43 35.5 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.327 0.584 . . . . 0.0 111.971 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -120.14 -15.32 8.72 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.977 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -86.11 -3.87 59.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.06 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.22 117.64 41.98 Favored Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.045 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -65.73 130.2 24.17 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.418 2.079 . . . . 0.0 112.061 -177.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.42 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.8 tt0 -97.18 100.02 11.5 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.255 0.55 . . . . 0.0 109.573 178.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 79.1 m-85 -85.76 145.16 27.37 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.029 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -123.47 112.75 17.88 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.618 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -100.83 131.39 48.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.694 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.443 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -120.81 150.51 40.91 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.536 ' HG2' HD12 ' B' ' 48' ' ' LEU . 2.3 ttt -135.63 134.49 39.31 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -176.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 10.2 tmtt? -142.83 132.55 23.94 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.996 -0.281 . . . . 0.0 110.527 -172.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.472 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.5 OUTLIER -95.01 133.01 39.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.132 0.492 . . . . 0.0 111.006 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -111.85 140.33 46.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.012 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -118.4 121.97 41.64 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.275 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.01 46.54 43.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.638 -179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.09 170.94 14.26 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.49 -14.41 62.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.106 0.479 . . . . 0.0 110.768 178.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.485 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -134.82 137.69 43.56 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.611 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.542 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -96.32 -23.2 16.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.519 . . . . 0.0 109.841 -173.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.552 HD11 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.35 133.51 34.96 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.448 -176.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -119.31 122.46 41.92 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.552 ' CD1' HD11 ' B' ' 48' ' ' LEU . 2.4 mp -117.4 131.56 69.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.618 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 3.4 mm? -117.52 118.03 31.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 -176.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -122.71 103.74 13.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.9 pt-20 -110.42 153.41 25.03 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.371 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . 0.403 ' OD1' ' HB3' ' B' ' 59' ' ' SER . 1.7 t-20 -102.12 108.82 20.36 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.365 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -134.01 92.84 3.01 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.651 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.453 ' HB1' ' OG ' ' B' ' 59' ' ' SER . . . -136.71 160.93 64.59 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.663 175.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' B' ' 56' ' ' ALA . 17.8 Cg_endo -56.07 -44.57 45.61 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.698 2.265 . . . . 0.0 110.839 175.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -134.35 88.61 2.47 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.033 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.501 ' C ' ' HD2' ' B' ' 60' ' ' LYS . 4.2 m -95.5 111.58 23.46 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.749 -174.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.501 ' HD2' ' C ' ' B' ' 59' ' ' SER . 0.7 OUTLIER -122.13 75.7 40.75 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.503 178.212 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.56 151.65 47.49 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.011 2.474 . . . . 0.0 111.704 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -84.5 -52.62 6.01 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.025 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -169.55 -178.76 3.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.832 -177.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -127.31 108.03 10.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.975 170.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 50.6 m -138.3 79.97 29.43 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.454 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 71.9 Cg_endo -81.38 153.31 18.25 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.634 2.223 . . . . 0.0 113.102 -178.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.496 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 99.2 p -159.09 150.38 20.27 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.206 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.449 ' HB2' HD23 ' B' ' 75' ' ' LEU . 45.0 t80 -108.83 128.01 54.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.597 -177.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.613 ' O ' ' HA ' ' B' ' 73' ' ' ASN . 0.1 OUTLIER -108.2 128.11 54.43 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 176.512 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -75.1 -25.41 58.51 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.297 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' A' ' 3' ' ' HIS . . . -60.79 -51.45 69.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.816 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.56 ' O ' HD11 ' B' ' 74' ' ' ILE . 11.0 mm-40 -103.62 -10.6 18.28 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . 0.613 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 1.8 p-10 59.95 45.34 12.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.499 1.143 . . . . 0.0 110.183 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.56 HD11 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.7 143.8 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 113.914 -1.494 . . . . 0.0 109.099 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.449 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.2 tm? -110.27 97.83 7.21 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.454 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -87.42 143.69 27.11 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.037 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 45.3 mm -95.84 -56.08 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.417 -171.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -160.46 24.0 0.15 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -174.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.1 -22.94 5.58 Favored Glycine 0 C--N 1.322 -0.246 0 C-N-CA 120.122 -1.037 . . . . 0.0 112.774 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -79.48 -28.61 41.48 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.475 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.7 OUTLIER -162.45 153.54 17.63 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.325 175.031 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' SER . . . . . 0.436 ' O ' ' HD3' ' B' ' 84' ' ' PRO . 63.5 p -124.3 150.61 45.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.571 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -106.93 100.14 30.15 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.809 0.338 . . . . 0.0 110.328 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.468 ' HA ' HD12 ' B' ' 74' ' ' ILE . 25.9 Cg_exo -65.91 131.5 27.44 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.686 2.257 . . . . 0.0 112.005 177.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.448 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 87.6 mt -101.72 151.37 37.89 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.261 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.35 143.24 31.15 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.647 2.231 . . . . 0.0 112.206 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.409 ' HD3' ' N ' ' B' ' 87' ' ' ARG . 0.0 OUTLIER -80.28 -3.38 49.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.5 -178.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -82.44 -9.62 59.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 59.9 mt -118.88 136.49 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.429 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.7 p -87.55 115.11 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 48.1 t -123.06 136.18 60.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.095 0.474 . . . . 0.0 111.248 -174.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.725 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.48 164.54 29.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.965 178.396 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.16 -23.83 65.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.652 -176.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.67 -12.03 56.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.769 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.725 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 14.4 t0 -104.06 -24.64 13.19 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.787 0.803 . . . . 0.0 109.244 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.36 117.69 24.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.219 -179.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.417 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.6 mmmt -112.09 108.0 17.12 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.985 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.406 HG21 HG21 ' A' ' 10' ' ' VAL . 47.2 mt -111.63 118.26 57.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -132.45 121.83 24.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.269 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 38.4 t-80 -107.02 112.09 24.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.958 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.53 HG21 ' H ' ' B' ' 104' ' ' GLU . 3.9 mp -85.18 108.35 16.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -76.12 -24.9 54.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.119 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.5 -46.5 89.73 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.53 ' H ' HG21 ' B' ' 101' ' ' ILE . 14.6 mt-10 -92.12 -2.2 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.28 0.562 . . . . 0.0 110.096 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 47.6 mtp180 54.23 38.91 30.21 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.287 -177.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.418 HG22 ' HB3' ' B' ' 53' ' ' GLU . 32.8 m -123.34 131.95 53.83 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.82 -172.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.73 114.89 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.454 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.607 ' CE2' HD11 ' B' ' 51' ' ' LEU . 48.6 m-85 -93.67 120.87 34.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.05 177.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.483 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.4 mm -110.88 123.85 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.974 177.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 84.7 m-85 -122.69 129.12 51.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 63.8 mt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.738 -0.649 . . . . 0.0 109.618 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 112.173 -0.371 . . . . 0.0 112.173 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.47 -22.75 71.2 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.872 2.381 . . . . 0.0 113.077 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -96.34 83.33 3.54 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 44.8 ttm -57.72 125.6 23.69 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 177.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 27.2 p -149.36 148.56 29.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.343 0.592 . . . . 0.0 112.316 -174.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.2 m -128.75 142.54 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.549 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.11 137.81 32.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 -177.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 mm -109.04 118.66 50.84 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.71 123.89 10.19 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.122 1.881 . . . . 0.0 111.849 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 p -96.14 127.92 47.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.773 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.431 HG11 HG13 ' A' ' 13' ' ' VAL . 58.6 t -92.12 128.21 43.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.71 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 39.5 mt-10 -97.49 109.11 21.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.328 0.585 . . . . 0.0 110.322 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.535 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.5 m -131.76 176.14 9.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.553 -177.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -101.2 -9.73 21.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.652 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -164.3 156.38 16.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.926 176.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.457 HD22 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -83.78 153.7 64.37 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.12 177.336 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -51.89 167.07 0.5 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.38 2.72 . . . . 0.0 113.318 173.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -72.3 130.54 41.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.99 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.6 29.91 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -173.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.28 153.05 18.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.071 0.462 . . . . 0.0 110.762 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -110.25 97.75 7.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.872 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.552 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 53.1 ttp85 -97.43 144.84 26.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.071 0.462 . . . . 0.0 111.683 -176.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.7 p . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.322 -0.854 . . . . 0.0 108.754 174.482 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo . . . . . 0 N--CA 1.475 0.433 0 N-CA-C 110.342 -0.676 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 55.2 48.97 18.28 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.822 0.82 . . . . 0.0 110.039 -175.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.95 27.81 4.22 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.629 -177.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -110.62 148.8 31.46 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.087 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -102.01 167.45 10.03 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.367 0.604 . . . . 0.0 111.012 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -95.35 -5.75 42.66 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.751 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . 0.668 ' HA ' ' O ' ' B' ' 58' ' ' ASN . 9.9 m-20 -82.91 -14.06 54.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.643 175.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 95.0 t -60.33 116.57 18.32 Favored Pre-proline 0 N--CA 1.451 -0.401 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.153 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.52 129.06 24.0 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.395 2.064 . . . . 0.0 112.242 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 34.0 tt0 -106.76 99.51 9.07 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.126 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 90.4 m-85 -86.89 152.66 22.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.478 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -120.53 110.58 16.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.009 176.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 57.3 t -92.96 124.21 45.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.397 -178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.465 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -121.57 137.92 54.53 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.107 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.463 ' HG2' HD13 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -120.43 139.83 52.26 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 -175.748 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.509 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.2 135.72 21.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.678 0.275 . . . . 0.0 110.295 -176.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.509 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -97.66 135.48 39.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 -178.128 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -118.26 147.53 43.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.458 177.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -133.72 119.8 19.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.065 0.459 . . . . 0.0 110.494 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.85 26.97 52.19 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.109 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.79 171.25 8.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.91 -13.98 60.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.133 0.492 . . . . 0.0 110.98 179.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.54 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -133.09 146.33 51.55 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 176.537 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.531 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -100.95 -22.26 14.84 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.23 0.538 . . . . 0.0 109.726 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.495 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.94 135.42 36.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.225 -178.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -120.46 129.16 53.75 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.525 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -123.16 131.65 72.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.608 HD13 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -115.14 117.13 29.67 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.2 102.9 13.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.461 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.9 pt-20 -109.05 153.32 23.81 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.896 0.379 . . . . 0.0 110.168 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.62 113.85 26.07 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.91 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.456 ' HB2' ' HZ1' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.02 93.23 3.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.368 0.604 . . . . 0.0 110.562 178.066 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.455 ' HB1' ' HD2' ' B' ' 57' ' ' PRO . . . -137.27 163.23 50.44 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.757 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.455 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 14.0 Cg_endo -57.12 -44.52 43.16 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.036 1.824 . . . . 0.0 111.416 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . 0.668 ' O ' ' HA ' ' B' ' 30' ' ' ASP . 29.0 m-80 -137.74 68.22 1.41 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.888 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 12.0 p -61.53 115.46 3.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.433 0.635 . . . . 0.0 111.556 -175.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.404 ' HE3' ' HA ' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -126.15 73.01 71.71 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.782 177.707 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -70.99 147.18 54.39 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.357 2.038 . . . . 0.0 111.395 176.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -86.86 -54.16 4.51 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.839 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -166.92 175.98 7.31 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.597 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -125.49 111.37 14.99 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.473 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.0 t -131.96 78.17 70.22 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.54 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 81.6 Cg_endo -81.1 151.39 18.2 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.766 2.31 . . . . 0.0 113.621 -178.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.42 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 15.2 m -156.08 150.53 25.76 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.035 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.478 ' CZ ' HG11 ' B' ' 91' ' ' VAL . 40.1 t80 -108.02 124.35 50.04 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.714 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.526 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.8 p-10 -103.3 112.36 25.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.109 0.481 . . . . 0.0 110.55 176.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.61 -33.01 73.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.575 -177.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.64 -48.92 68.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.623 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.559 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.4 mt-10 -110.54 5.93 21.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.411 -176.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 48.51 43.16 19.82 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.397 1.06 . . . . 0.0 111.587 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.559 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.2 mt -118.15 143.32 29.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.555 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.406 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -109.32 101.81 10.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.54 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -88.6 142.81 27.39 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.826 -178.086 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 47.5 mm -96.05 -48.92 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.576 -177.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -165.71 -168.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.584 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.75 -4.94 59.7 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.007 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -86.5 -40.12 15.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.493 ' O ' HD11 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -161.6 154.02 20.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.602 0.715 . . . . 0.0 112.675 -179.762 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.9 p -123.58 148.25 46.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.415 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.6 mm -105.23 105.21 51.06 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 120.621 0.248 . . . . 0.0 110.536 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.493 ' HA ' HG12 ' B' ' 74' ' ' ILE . 59.1 Cg_endo -74.85 131.58 14.64 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.138 1.892 . . . . 0.0 111.77 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 65.9 mt -99.79 154.08 37.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.031 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.43 139.91 46.57 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.335 2.023 . . . . 0.0 112.061 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -77.59 -6.85 55.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 -177.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -84.76 -12.43 53.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.302 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.6 mt -113.96 133.83 58.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.986 -176.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.5 127.78 39.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.481 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . 0.478 HG11 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -137.35 138.91 44.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.259 0.552 . . . . 0.0 111.524 -174.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.536 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.33 166.38 24.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.044 178.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.09 -22.57 64.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.147 0.499 . . . . 0.0 111.572 -177.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.81 -9.75 55.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.114 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.536 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 31.0 t70 -107.08 -23.76 12.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.755 0.788 . . . . 0.0 109.688 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.9 mt -74.74 116.69 17.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.443 179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.411 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.4 mmmm -111.34 105.36 13.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.894 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 56.3 mt -110.17 120.55 61.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.994 -178.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.23 119.2 21.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.422 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.4 t-80 -97.14 108.03 20.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.675 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.535 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 46.8 mt -86.7 98.01 6.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 172.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -72.99 -20.59 60.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -58.15 -49.09 78.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.472 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.456 ' H ' HG23 ' B' ' 101' ' ' ILE . 8.4 mm-40 -99.88 1.14 42.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.538 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 55.02 36.13 26.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.269 -175.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.44 HG22 ' HB3' ' B' ' 53' ' ' GLU . 22.7 m -116.73 126.4 53.1 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.35 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 54.3 tp -101.28 121.72 42.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.662 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.608 ' CE2' HD13 ' B' ' 51' ' ' LEU . 21.2 m-85 -101.97 128.29 48.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.384 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.525 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.6 mm -116.3 122.0 68.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.66 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.473 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 86.0 m-85 -122.44 126.35 47.74 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.54 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--N 1.319 -0.752 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.715 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.677 0 N-CA-C 111.812 -0.515 . . . . 0.0 111.812 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.06 164.41 22.37 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.839 2.36 . . . . 0.0 112.208 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -124.53 63.28 1.11 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.331 0.586 . . . . 0.0 109.566 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 83.0 mtp -81.96 137.41 35.15 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.798 -176.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.459 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 28.5 p -158.68 127.13 5.31 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.014 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.3 m -124.22 140.73 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.068 0.461 . . . . 0.0 110.642 -178.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 135.1 35.03 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.157 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.4 mm -112.07 114.18 51.47 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -71.5 135.81 27.19 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 121.869 1.712 . . . . 0.0 111.08 175.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.4 p -100.41 128.59 52.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.748 -177.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.421 HG11 HG12 ' A' ' 13' ' ' VAL . 47.6 t -87.26 112.68 23.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.766 179.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.435 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.7 mt-10 -92.13 106.76 18.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.444 0.64 . . . . 0.0 110.223 179.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.421 HG12 HG11 ' A' ' 11' ' ' VAL . 2.2 m -129.21 -172.57 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.084 -175.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -96.87 -30.22 13.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.143 0.497 . . . . 0.0 109.661 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -149.66 166.05 30.51 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.233 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.474 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.8 mm? -80.05 141.47 54.5 Favored Pre-proline 0 C--N 1.316 -0.874 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.198 173.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.71 166.47 0.23 Allowed 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 123.485 2.79 . . . . 0.0 113.029 172.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -68.56 132.34 46.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.578 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.1 -2.17 29.91 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.638 -174.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -102.46 175.18 5.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.996 0.427 . . . . 0.0 111.142 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.59 112.33 12.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.707 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.474 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.5 ttp85 -118.75 147.75 43.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.3 m . . . . . 0 C--O 1.244 0.792 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.869 179.48 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo . . . . . 0 N--CA 1.473 0.291 0 N-CA-C 110.422 -0.645 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -89.63 80.52 6.62 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.4 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 60.29 -160.69 0.29 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.636 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -72.86 177.0 5.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.434 0.635 . . . . 0.0 111.227 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -110.42 159.15 17.74 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.766 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -75.81 -15.19 60.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.317 -175.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -88.37 -4.03 58.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.533 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 49.0 t -79.59 114.1 42.76 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.721 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -72.33 133.98 21.94 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 122.639 2.226 . . . . 0.0 112.257 177.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -108.21 100.07 9.42 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.409 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 96.1 m-85 -90.5 154.92 19.27 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.372 -178.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -120.0 108.9 14.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.068 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 92.1 t -91.11 129.36 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.008 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.428 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -127.07 142.75 51.45 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 176.791 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.491 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.3 ttt -123.97 141.21 52.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.637 -175.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.453 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.9 tmtt? -140.92 133.47 28.57 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.562 -176.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.453 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 9.2 mpt_? -99.34 138.73 36.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.995 0.426 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -118.77 167.32 11.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.448 177.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.31 105.23 4.02 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.013 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.84 46.96 6.9 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.891 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.98 172.19 12.96 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 -25.27 64.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.554 0.692 . . . . 0.0 110.492 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.542 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -131.8 141.95 49.6 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.684 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.518 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.05 -21.42 15.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.266 0.555 . . . . 0.0 109.679 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.491 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -139.66 135.29 33.09 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.781 -178.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -124.51 133.6 53.28 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.48 ' CD1' HD13 ' B' ' 48' ' ' LEU . 2.4 mp -125.45 132.37 71.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.465 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.4 mm? -113.55 121.99 45.89 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.3 103.13 11.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 177.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 14.0 pt-20 -114.99 153.41 30.67 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.106 0.479 . . . . 0.0 110.305 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -95.94 110.2 22.45 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.423 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -130.04 94.11 3.64 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.868 0.842 . . . . 0.0 110.536 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.477 ' HB3' ' HB2' ' B' ' 59' ' ' SER . . . -133.84 157.8 76.96 Favored Pre-proline 0 C--N 1.311 -1.084 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.515 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.03 -22.95 76.36 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.982 2.455 . . . . 0.0 111.531 174.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -139.64 -91.02 0.18 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.324 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.477 ' HB2' ' HB3' ' B' ' 56' ' ' ALA . 44.1 t 70.01 138.93 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 122.031 0.919 . . . . 0.0 111.97 178.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -137.66 79.11 35.49 Favored Pre-proline 0 C--N 1.313 -0.996 0 CA-C-N 114.663 -1.153 . . . . 0.0 108.786 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -60.87 137.02 69.8 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.081 2.521 . . . . 0.0 112.634 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . 0.496 ' OD2' ' HG2' ' B' ' 63' ' ' ARG . 22.2 t70 -81.79 -74.14 0.35 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.656 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.496 ' HG2' ' OD2' ' B' ' 62' ' ' ASP . 20.1 ptt180 -166.87 175.29 7.83 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 175.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -115.16 116.0 27.66 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -136.92 79.64 38.34 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-O 121.096 0.474 . . . . 0.0 109.782 175.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -80.03 158.38 23.83 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.982 2.455 . . . . 0.0 113.486 -178.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 90.8 p -158.56 147.89 19.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.074 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.417 ' HB2' HD23 ' B' ' 75' ' ' LEU . 53.8 t80 -106.95 117.97 35.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.196 0.522 . . . . 0.0 110.847 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.459 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.5 p-10 -100.02 110.18 22.5 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.526 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -60.52 -33.58 72.85 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.66 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -51.79 -44.14 63.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.719 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.449 ' O ' HG13 ' B' ' 74' ' ' ILE . 4.1 mm-40 -111.56 4.0 18.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.46 44.9 17.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.422 -176.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.476 HG12 ' HA ' ' B' ' 84' ' ' PRO . 55.6 mt -121.74 135.05 63.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.163 -178.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.417 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -100.84 100.85 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.83 144.63 28.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -177.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.8 mm -98.41 -59.57 3.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.299 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -144.88 -178.04 5.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.419 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.98 3.61 27.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.749 176.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -90.21 -40.56 12.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.538 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.4 pp -160.22 153.29 21.68 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.624 -0.717 . . . . 0.0 112.224 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.9 p -121.07 147.56 45.36 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.65 174.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.0 mm -102.71 103.99 36.02 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.852 0.358 . . . . 0.0 110.344 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.476 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.3 Cg_endo -81.88 130.38 6.62 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.281 1.988 . . . . 0.0 112.599 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -96.86 147.2 32.57 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.955 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.36 140.65 64.77 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.199 1.932 . . . . 0.0 111.343 175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.14 -5.74 41.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.429 -175.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -81.5 -11.57 59.15 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.311 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 58.8 mt -114.84 136.64 50.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.902 -176.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.1 p -84.51 113.41 23.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.215 0.531 . . . . 0.0 109.971 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 62.1 t -120.49 130.72 74.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-O 121.122 0.487 . . . . 0.0 111.128 -175.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.519 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.43 164.43 30.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.912 177.962 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.22 -18.01 63.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.871 -176.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.4 -14.82 48.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.831 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.519 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 20.4 t70 -108.67 -23.98 11.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.837 -175.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . 0.431 HG21 HG13 ' B' ' 98' ' ' ILE . 80.5 mt -73.45 115.33 14.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.18 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -110.09 98.82 8.01 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.575 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.431 HG13 HG21 ' B' ' 96' ' ' ILE . 39.2 mt -99.84 116.72 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.005 0.431 . . . . 0.0 110.766 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -130.66 121.34 25.38 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.095 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.435 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 75.6 t60 -109.54 125.29 52.35 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.047 0.451 . . . . 0.0 110.882 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.477 HD11 ' CE1' ' B' ' 108' ' ' TYR . 85.4 mt -104.12 113.02 39.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.973 177.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.51 -23.38 61.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.709 0.29 . . . . 0.0 110.573 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.467 ' H ' HG21 ' B' ' 101' ' ' ILE . 42.7 mt-10 -95.23 0.67 54.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.135 0.493 . . . . 0.0 109.985 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 51.71 37.29 19.79 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.207 -173.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 62.4 m -121.52 133.98 55.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.535 -173.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.33 118.16 36.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.964 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.493 ' HB3' ' CE1' ' B' ' 110' ' ' TYR . 29.8 m-85 -98.12 119.05 36.09 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.9 179.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.3 mm -108.99 123.0 64.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.843 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.493 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 67.7 m-85 -122.53 126.64 48.21 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.542 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.776 -0.631 . . . . 0.0 109.775 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.725 0 N-CA-C 111.749 -0.54 . . . . 0.0 111.749 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.43 81.82 0.71 Allowed 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.057 2.505 . . . . 0.0 113.118 -175.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.415 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 46.7 t60 175.33 -54.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.48 135.33 0.06 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.917 -1.038 . . . . 0.0 108.877 179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 13.4 p -145.24 126.05 14.36 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.809 0.338 . . . . 0.0 110.589 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -114.79 140.86 33.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.203 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -86.11 139.11 31.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.098 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.44 ' HB ' HD13 ' B' ' 98' ' ' ILE . 4.0 mm -111.36 117.2 49.83 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.362 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -71.24 129.68 16.4 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.321 2.014 . . . . 0.0 112.428 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.07 137.07 21.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 67.6 t -101.15 112.95 35.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.539 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.0 mt-10 -94.98 107.88 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.418 0.628 . . . . 0.0 110.754 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.84 -173.27 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.631 -175.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.47 -33.57 36.57 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -175.46 175.78 2.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.741 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.44 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.9 mm? -78.17 140.66 61.6 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-O 120.772 0.32 . . . . 0.0 110.844 -177.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.97 173.65 9.95 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.81 2.34 . . . . 0.0 111.738 174.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -56.82 139.4 51.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.014 0.435 . . . . 0.0 110.952 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.04 -22.48 23.14 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.647 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.4 ' CB ' ' HB3' ' A' ' 16' ' ' LEU . 66.7 m-85 -93.7 166.55 12.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.441 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -124.9 99.49 6.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.386 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.52 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 57.9 ttp85 -97.08 147.57 23.9 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.681 -178.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.8 m . . . . . 0 C--O 1.251 1.18 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.302 178.786 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo . . . . . 0 N--CA 1.482 0.817 0 N-CA-C 110.511 -0.611 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -119.99 123.71 44.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.751 0.31 . . . . 0.0 110.942 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -87.8 99.35 12.04 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 174.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -85.56 145.39 27.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.064 -177.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -112.19 177.96 4.47 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.648 0.737 . . . . 0.0 111.152 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -120.98 -4.06 9.6 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.93 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -88.4 -8.69 54.6 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.881 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.53 114.5 13.35 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.328 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.54 130.0 11.42 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.716 2.278 . . . . 0.0 112.361 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -92.48 100.33 12.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.422 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 68.0 m-85 -87.19 153.88 21.16 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.417 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -132.87 116.59 16.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.543 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.7 p -102.27 132.3 48.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.01 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.61 151.35 44.94 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.545 ' HG2' HD13 ' B' ' 48' ' ' LEU . 1.0 OUTLIER -128.55 137.46 51.75 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -177.323 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.41 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 2.5 tmtp? -143.68 132.37 22.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.611 0.244 . . . . 0.0 110.413 -174.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.41 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.3 OUTLIER -95.65 141.4 29.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.335 -177.018 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -121.13 147.12 46.01 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -119.43 118.54 31.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.941 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.23 51.77 46.81 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.562 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.9 171.7 13.58 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.57 -16.95 62.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.251 0.548 . . . . 0.0 110.74 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.586 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -133.53 144.18 49.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.916 176.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.527 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.7 mppt? -98.87 -23.53 15.32 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -178.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.545 HD13 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -137.63 134.94 36.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.222 -179.125 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.484 ' N ' HD11 ' B' ' 48' ' ' LEU . 26.3 ttp180 -120.18 117.89 29.07 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.539 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -111.91 130.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.1 mm? -112.62 112.85 24.68 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.375 -176.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.16 103.38 14.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.436 ' HB3' HG21 ' B' ' 106' ' ' THR . 10.3 pt-20 -113.28 150.31 32.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.026 0.441 . . . . 0.0 110.68 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -94.93 113.7 25.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.021 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' B' ' 55' ' ' LYS . 7.2 ptmm? -137.26 93.03 2.77 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.492 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.46 ' HB1' ' HB3' ' B' ' 59' ' ' SER . . . -132.63 162.09 59.39 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.577 175.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -60.7 -41.71 44.75 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.375 2.05 . . . . 0.0 110.454 171.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -142.48 99.29 3.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.718 -1.128 . . . . 0.0 109.194 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.46 ' HB3' ' HB1' ' B' ' 56' ' ' ALA . 5.5 p -133.03 138.22 46.72 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.616 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.476 ' HA ' ' HE2' ' B' ' 60' ' ' LYS . 6.6 mmpt? -131.87 75.0 76.52 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.478 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -77.71 138.25 16.84 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.201 1.934 . . . . 0.0 111.469 172.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -108.04 -49.12 3.26 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.926 -177.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 22.8 ptt180 -157.94 176.45 12.53 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.421 -175.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -133.03 143.87 49.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.523 -178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 p -133.45 78.74 62.14 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.455 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 86.3 Cg_endo -83.81 152.93 13.12 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.679 2.253 . . . . 0.0 112.158 179.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.49 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.9 m -156.03 141.63 17.8 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.184 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.45 ' HH ' HG12 ' B' ' 91' ' ' VAL . 51.0 t80 -99.52 129.41 45.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.326 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.536 HD22 ' HB2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -108.28 131.09 55.07 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.562 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -79.02 -24.28 43.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.332 -178.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . 0.415 ' HB2' ' HB3' ' A' ' 3' ' ' HIS . . . -62.96 -51.71 65.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.476 . . . . 0.0 110.988 -176.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.575 ' O ' HG13 ' B' ' 74' ' ' ILE . 3.6 mt-10 -104.86 -2.34 24.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.284 178.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . 0.405 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 2.2 p-10 58.94 39.62 23.47 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.171 0.986 . . . . 0.0 110.229 174.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.575 HG13 ' O ' ' B' ' 72' ' ' GLU . 86.2 mt -118.67 136.3 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 114.447 -1.252 . . . . 0.0 111.131 -177.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -100.1 100.52 11.39 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.49 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -87.68 141.18 28.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.587 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.8 mm -90.94 -49.64 13.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.89 -175.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.2 m-20 -157.92 -170.54 3.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.39 21.19 5.35 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.398 178.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -107.07 -47.17 3.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.31 0.576 . . . . 0.0 110.038 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.489 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.7 OUTLIER -151.1 153.08 34.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.296 -178.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 24.1 p -126.97 145.51 50.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.951 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.5 102.75 39.43 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-O 120.817 0.341 . . . . 0.0 110.66 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.493 ' HA ' HG12 ' B' ' 74' ' ' ILE . 74.1 Cg_endo -78.74 134.59 12.21 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.157 1.905 . . . . 0.0 112.3 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -98.49 153.27 38.06 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.464 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.59 140.61 57.48 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.488 2.126 . . . . 0.0 111.322 175.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.61 -8.66 57.33 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.211 -176.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.75 -13.35 59.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.282 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 57.7 mt -114.15 135.15 54.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.895 -177.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 90.7 t -86.79 114.47 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . 0.45 HG12 ' HH ' ' B' ' 68' ' ' TYR . 2.0 p -123.44 134.85 65.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.329 0.585 . . . . 0.0 111.325 -175.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.477 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.06 166.43 24.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.546 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.6 -12.26 60.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.749 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.63 -9.87 48.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.37 0.605 . . . . 0.0 110.637 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.477 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.2 t70 -111.39 -24.1 10.39 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.766 -178.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.4 mt -73.73 120.1 22.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.284 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.429 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -113.82 103.05 10.81 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.69 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.44 HD13 ' HB ' ' A' ' 8' ' ' ILE . 37.5 mt -105.75 120.98 57.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.98 0.419 . . . . 0.0 111.439 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -132.85 121.25 22.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.472 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.539 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 15.5 t-80 -105.24 117.9 35.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.42 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.596 HG23 ' H ' ' B' ' 104' ' ' GLU . 2.3 mp -91.49 125.34 44.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . 0.424 ' HD3' ' OE2' ' A' ' 12' ' ' GLU . 12.1 mmm180 -76.22 -42.61 45.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.465 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -59.53 -47.82 84.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.681 -175.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.596 ' H ' HG23 ' B' ' 101' ' ' ILE . 16.0 mm-40 -87.47 -3.94 59.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.859 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 53.54 38.97 29.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.858 -175.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.436 HG21 ' HB3' ' B' ' 53' ' ' GLU . 59.6 m -125.92 137.87 53.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.93 0.395 . . . . 0.0 111.097 -172.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . 0.473 HD12 ' HB2' ' B' ' 100' ' ' HIS . 27.5 tp -109.23 119.72 40.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.181 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.545 ' CE1' HD12 ' B' ' 101' ' ' ILE . 47.4 m-85 -102.11 129.16 48.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.539 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.2 mm -115.39 118.43 58.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.808 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.429 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.7 m-85 -117.18 125.7 51.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.586 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.2 mt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.655 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.717 0 N-CA-C 112.087 -0.405 . . . . 0.0 112.087 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.69 119.84 7.24 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.795 2.33 . . . . 0.0 111.895 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.479 ' HA ' ' HB1' ' B' ' 71' ' ' ALA . 42.9 m80 -90.39 64.32 5.89 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.841 -177.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 48.1 ttm -93.86 129.79 40.14 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.338 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 33.1 p -135.46 127.28 29.31 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.064 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -117.45 143.01 29.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.752 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.82 137.47 32.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.308 -178.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.417 ' HB ' HD13 ' B' ' 98' ' ' ILE . 4.3 mm -109.78 114.94 56.12 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.31 128.69 14.01 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.292 1.995 . . . . 0.0 112.269 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.52 132.67 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.111 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.408 HG11 HG12 ' A' ' 13' ' ' VAL . 79.4 t -94.72 114.55 31.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 174.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.47 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 23.0 mt-10 -91.1 111.2 22.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.549 0.69 . . . . 0.0 110.811 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.408 HG12 HG11 ' A' ' 11' ' ' VAL . 2.6 m -127.55 179.26 3.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.513 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -89.84 -28.05 19.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.147 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -169.64 164.14 10.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.977 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.49 HD21 ' HD2' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -78.92 143.72 62.47 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 120.692 0.282 . . . . 0.0 110.331 -178.351 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -71.35 175.04 9.92 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.917 2.412 . . . . 0.0 112.44 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.94 138.57 11.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.707 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.1 -5.09 61.09 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.166 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -106.49 149.23 27.3 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.172 0.51 . . . . 0.0 111.653 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -110.68 98.09 7.34 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.245 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.49 ' HD2' HD21 ' A' ' 16' ' ' LEU . 10.0 ttt180 -80.21 143.86 33.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.181 -178.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 t . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.373 -0.822 . . . . 0.0 110.238 -176.514 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.476 0.486 0 N-CA-C 109.996 -0.809 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 7.2 t-160 -66.9 -54.86 18.0 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 62.12 102.29 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.72 0.637 . . . . 0.0 111.373 176.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -76.47 158.91 30.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.448 0.642 . . . . 0.0 111.309 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -97.56 154.38 17.56 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.326 -177.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -94.45 -14.38 25.26 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.631 -172.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . 0.548 ' OD2' ' HE3' ' B' ' 60' ' ' LYS . 7.2 p-10 -83.36 -13.43 54.99 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.814 177.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 63.8 t -68.41 119.71 70.03 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.441 177.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.491 ' HA ' ' CB ' ' B' ' 59' ' ' SER . 36.6 Cg_endo -69.37 129.73 18.55 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.346 2.03 . . . . 0.0 111.723 177.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -105.74 99.19 8.8 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.488 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.417 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.3 m-85 -87.06 137.77 32.06 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.498 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.507 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 36.1 tt0 -110.19 113.7 26.59 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.04 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 96.8 t -93.98 124.06 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.917 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.527 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -118.58 131.76 56.2 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.22 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.539 ' HG2' HD12 ' B' ' 48' ' ' LEU . 1.5 ttt -118.91 135.78 54.4 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -176.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.479 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 5.3 tmtm? -142.57 131.65 23.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.869 0.366 . . . . 0.0 110.775 -173.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.479 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -90.5 132.04 35.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.927 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -116.69 149.01 40.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.904 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -132.29 122.62 25.42 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.547 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.03 23.85 58.65 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.307 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -113.28 170.8 7.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.79 -11.01 60.53 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 177.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.497 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.59 142.05 43.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.568 177.102 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.505 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.29 -19.69 18.38 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.148 0.499 . . . . 0.0 109.752 -175.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.539 HD12 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -135.83 132.76 37.06 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.65 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -115.93 122.02 44.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.202 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.546 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -121.41 128.95 75.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.529 HD11 ' CD2' ' B' ' 108' ' ' TYR . 3.7 mm? -114.83 120.61 40.6 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -122.12 103.56 13.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.417 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -113.06 153.49 28.05 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.147 0.499 . . . . 0.0 110.312 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.51 111.33 23.7 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.343 -176.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.413 ' HB2' ' HE2' ' B' ' 55' ' ' LYS . 7.6 ptmm? -134.7 92.19 2.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.182 0.515 . . . . 0.0 110.837 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' B' ' 59' ' ' SER . . . -137.34 162.05 57.38 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.276 176.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -49.5 -43.91 37.01 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.3 2.667 . . . . 0.0 112.176 -175.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -130.76 -67.28 0.72 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.996 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.544 ' HB3' ' HB1' ' B' ' 56' ' ' ALA . 53.3 p 58.37 131.14 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 173.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.548 ' HE3' ' OD2' ' B' ' 30' ' ' ASP . 21.6 pttp -120.6 83.15 34.39 Favored Pre-proline 0 N--CA 1.446 -0.651 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.755 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -59.47 140.31 93.51 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.693 2.262 . . . . 0.0 111.728 176.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -90.08 -76.15 0.43 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.706 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -159.31 176.33 12.29 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.185 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -126.36 108.97 11.73 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.14 0.495 . . . . 0.0 110.539 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.4 t -134.66 79.63 52.58 Favored Pre-proline 0 C--N 1.317 -0.812 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.039 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.471 ' C ' ' HG ' ' B' ' 67' ' ' SER . 83.9 Cg_endo -84.08 158.18 13.36 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.813 2.342 . . . . 0.0 112.019 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.471 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 19.3 m -158.1 144.57 17.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.038 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.413 ' HB2' HD22 ' B' ' 75' ' ' LEU . 72.2 t80 -104.34 128.95 52.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.358 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.431 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.1 OUTLIER -109.69 125.33 52.52 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.632 178.311 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -75.72 -24.82 56.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.444 -175.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . 0.479 ' HB1' ' HA ' ' A' ' 3' ' ' HIS . . . -62.28 -42.0 98.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.492 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.55 ' O ' HD11 ' B' ' 74' ' ' ILE . 12.6 mt-10 -112.96 -7.81 13.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.291 178.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 60.52 42.35 14.36 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 124.644 1.215 . . . . 0.0 110.38 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.55 HD11 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.67 138.51 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.008 178.266 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' B' ' 68' ' ' TYR . 2.8 tm? -106.33 99.86 9.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.12 144.66 27.4 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.7 mm -105.25 -49.37 9.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.076 0.465 . . . . 0.0 111.193 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.424 ' C ' ' H ' ' B' ' 80' ' ' LYS . 0.4 OUTLIER -146.65 174.31 11.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -175.503 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.82 4.75 28.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.437 -0.887 . . . . 0.0 111.255 174.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . 0.424 ' H ' ' C ' ' B' ' 78' ' ' ASN . 30.2 mttp -101.43 -34.57 9.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.906 -0.647 . . . . 0.0 110.424 -177.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.408 ' O ' HD11 ' B' ' 81' ' ' LEU . 0.5 OUTLIER -157.62 152.51 25.48 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.56 0.695 . . . . 0.0 111.989 -177.173 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 28.4 p -133.3 143.61 49.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.805 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.5 mm -101.76 106.48 47.1 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.475 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.473 ' HA ' HD12 ' B' ' 74' ' ' ILE . 73.4 Cg_endo -82.1 135.12 8.42 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.135 1.89 . . . . 0.0 112.343 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.59 149.05 35.54 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.55 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -68.34 142.47 54.88 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.148 1.899 . . . . 0.0 111.337 175.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.451 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 8.9 mpt_? -78.74 -0.06 28.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.682 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -81.78 -15.61 53.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.043 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 51.5 mt -109.98 134.12 53.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.979 -176.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.96 114.38 25.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.64 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 51.4 t -120.6 135.5 60.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.303 0.573 . . . . 0.0 111.246 -173.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.504 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.07 161.15 38.54 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.708 177.483 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.72 64.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.799 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.62 -16.03 49.91 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.061 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.504 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.1 t0 -104.05 -22.21 13.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.603 0.715 . . . . 0.0 109.706 -177.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.2 mt -73.99 119.28 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.276 178.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -113.14 108.86 17.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.856 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.417 HD13 ' HB ' ' A' ' 8' ' ' ILE . 55.5 mt -113.33 119.5 60.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.885 0.374 . . . . 0.0 111.296 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -128.56 117.7 21.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -178.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.47 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 32.3 t-80 -100.08 121.18 41.0 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.552 HG23 ' H ' ' B' ' 104' ' ' GLU . 70.5 mt -102.84 104.84 17.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 173.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -79.05 -18.05 54.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.186 -176.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.93 -44.33 85.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.424 0.631 . . . . 0.0 109.995 174.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.552 ' H ' HG23 ' B' ' 101' ' ' ILE . 8.8 tp10 -94.24 -4.42 48.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.083 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 57.1 35.1 25.88 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.738 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 61.4 m -126.65 137.3 53.28 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.851 -174.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.4 tp -106.52 125.31 50.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.277 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.529 ' CD2' HD11 ' B' ' 51' ' ' LEU . 21.6 m-85 -105.82 126.14 51.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.835 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.546 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.0 mm -116.48 124.92 73.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.027 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -126.63 126.79 44.17 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.5 mt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.006 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.0 124.2 13.15 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.842 2.362 . . . . 0.0 111.844 178.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' B' ' 70' ' ' PHE . 33.6 m170 -78.81 49.05 0.87 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.746 -178.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.407 ' CE ' ' HA ' ' A' ' 4' ' ' MET . 0.2 OUTLIER 64.96 175.55 0.2 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-O 122.027 0.918 . . . . 0.0 113.028 176.035 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 p -152.07 129.22 11.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.323 177.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.3 m -112.39 142.81 23.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.91 0.386 . . . . 0.0 110.875 -176.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.426 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -86.82 137.66 32.23 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.24 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.0 mm -109.11 121.79 41.74 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.874 -0.331 . . . . 0.0 110.272 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.2 127.83 14.78 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.368 2.045 . . . . 0.0 112.226 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 p -101.94 130.94 50.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 50.7 t -97.35 121.65 48.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.923 179.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.506 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 44.4 mt-10 -95.49 106.28 18.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.186 0.517 . . . . 0.0 110.799 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 3.6 m -128.79 -175.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.979 -177.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -99.46 -23.07 15.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.248 0.547 . . . . 0.0 109.879 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.73 156.3 36.11 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.87 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.91 146.09 48.25 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -69.24 173.66 10.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.553 2.168 . . . . 0.0 112.15 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -52.02 140.09 21.22 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.966 -177.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.34 -20.32 42.9 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.057 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -89.79 147.37 23.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.07 0.462 . . . . 0.0 111.509 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -108.02 106.47 16.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.477 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -117.88 151.45 37.36 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.501 177.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.044 -176.87 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.371 0 N-CA-C 110.057 -0.786 . . . . 0.0 110.057 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 49.0 m80 58.02 55.7 5.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.455 0.645 . . . . 0.0 110.838 -177.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.11 148.72 46.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.293 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -97.0 175.16 6.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.201 0.524 . . . . 0.0 111.352 -177.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . 0.47 ' HB2' HG21 ' B' ' 31' ' ' VAL . 24.9 mt-30 -144.38 155.37 43.75 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.194 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.48 ' O ' ' HB2' ' B' ' 58' ' ' ASN . 10.1 pt-20 -74.03 -20.58 60.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.747 -173.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -89.56 -4.35 57.9 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.326 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.47 HG21 ' HB2' ' B' ' 28' ' ' GLN . 21.6 t -79.32 116.77 62.9 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.309 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -65.4 128.94 21.37 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.145 1.896 . . . . 0.0 111.571 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -108.46 101.51 10.68 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.499 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 84.7 m-85 -81.87 148.36 28.84 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -124.35 115.32 20.81 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.578 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.6 p -102.41 134.86 41.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.94 -173.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.417 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -126.19 147.23 49.69 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.182 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.522 ' HG2' HD12 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -121.85 135.88 54.91 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.618 -178.464 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.499 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 4.9 tmtm? -137.05 131.94 33.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.336 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.406 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.6 OUTLIER -95.23 137.23 34.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.857 0.36 . . . . 0.0 111.101 -179.504 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.499 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 39.5 m-85 -119.62 160.5 22.37 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.733 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -143.08 121.55 12.41 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 76.8 29.58 57.24 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.447 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.03 171.73 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.44 -12.77 55.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.172 0.511 . . . . 0.0 110.485 177.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -137.75 146.55 43.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.862 177.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.512 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.58 -21.52 15.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.247 0.546 . . . . 0.0 109.609 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.03 136.99 38.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.352 -178.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.438 ' N ' HD13 ' B' ' 48' ' ' LEU . 62.9 ttp180 -124.38 121.6 35.38 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 174.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.54 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -113.73 129.86 68.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.578 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 4.4 mm? -112.36 115.09 28.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.136 -177.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.0 103.56 14.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.499 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -109.48 153.31 24.24 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.475 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . 0.458 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -94.74 114.44 26.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.994 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.408 ' N ' HD21 ' B' ' 54' ' ' ASN . 16.4 ptmt -137.94 92.18 2.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.282 0.563 . . . . 0.0 110.89 176.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.752 ' HB1' ' OG ' ' B' ' 59' ' ' SER . . . -136.43 167.39 21.78 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 174.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.562 ' HD2' ' HB3' ' B' ' 56' ' ' ALA . 3.3 Cg_endo -45.1 -43.47 15.98 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.436 2.757 . . . . 0.0 112.448 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' B' ' 29' ' ' GLU . 29.6 m-80 -129.7 -67.4 0.76 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.128 -177.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.752 ' OG ' ' HB1' ' B' ' 56' ' ' ALA . 15.4 m 67.93 120.82 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.711 -178.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.587 ' O ' ' HG3' ' B' ' 60' ' ' LYS . 21.2 pttm -118.91 81.22 19.02 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-O 121.649 0.738 . . . . 0.0 109.44 176.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -52.44 124.13 14.38 Favored 'Trans proline' 0 CA--C 1.513 -0.566 0 C-N-CA 122.924 2.416 . . . . 0.0 112.558 -177.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . 0.474 ' OD2' ' HD2' ' B' ' 63' ' ' ARG . 12.0 t70 -92.33 -73.3 0.56 Allowed 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 113.856 -1.52 . . . . 0.0 109.891 -177.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.474 ' HD2' ' OD2' ' B' ' 62' ' ' ASP . 0.1 OUTLIER -160.5 175.85 12.27 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 174.388 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -126.72 120.6 29.79 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.796 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 14.7 m -129.25 78.35 76.11 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 0.0 109.781 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.555 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 61.0 Cg_endo -81.45 145.37 14.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.317 2.011 . . . . 0.0 112.136 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.558 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.5 m -155.38 144.11 20.56 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.246 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.468 ' HH ' HG13 ' B' ' 91' ' ' VAL . 65.2 t80 -105.3 120.37 41.4 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.52 -177.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.458 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.1 p-10 -99.74 114.95 28.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.424 175.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.414 ' HB2' ' O ' ' A' ' 3' ' ' HIS . 85.1 m-85 -63.88 -32.12 73.53 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.42 -176.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.27 -41.81 69.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.973 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.537 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.98 1.79 15.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.623 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.73 45.55 21.76 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.363 1.039 . . . . 0.0 111.32 -175.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.537 HG13 ' O ' ' B' ' 72' ' ' GLU . 72.3 mt -123.26 137.62 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.135 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -105.8 107.05 17.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.558 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 10.8 p90 -95.36 144.82 25.59 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.165 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 49.3 mm -91.8 -40.77 12.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.721 -175.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.9 m-20 -161.16 -175.96 5.17 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.48 7.31 40.17 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.586 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.46 -37.99 11.15 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.074 0.464 . . . . 0.0 110.21 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.485 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.7 OUTLIER -159.26 153.01 22.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.944 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 10.1 p -128.16 141.62 51.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.642 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 45.5 mm -104.69 105.62 51.34 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.852 0.358 . . . . 0.0 110.673 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.469 ' HA ' HG12 ' B' ' 74' ' ' ILE . 73.6 Cg_endo -80.9 134.51 9.55 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.188 1.925 . . . . 0.0 112.632 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.48 143.84 27.17 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.76 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -67.27 142.2 59.63 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.133 1.889 . . . . 0.0 111.306 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -71.26 -5.01 28.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.125 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -75.31 -17.07 60.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.45 0.643 . . . . 0.0 109.709 178.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 53.5 mt -113.7 137.71 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.764 -176.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 60.6 t -90.64 113.9 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . 0.468 HG13 ' HH ' ' B' ' 68' ' ' TYR . 2.3 p -124.53 134.57 66.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.155 0.502 . . . . 0.0 111.185 -175.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 167.32 22.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.302 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.58 -23.68 64.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 111.556 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.89 -9.8 58.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.033 -177.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -113.89 -21.1 10.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.021 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 79.5 mt -75.33 117.97 20.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.354 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -113.07 107.83 16.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.68 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 46.7 mt -110.38 120.77 61.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 0.0 111.518 -177.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -133.23 119.52 19.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.614 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.506 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 16.9 t-80 -101.82 113.89 27.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.628 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.558 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.4 mt -89.93 108.43 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -69.2 -40.65 77.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.716 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -58.6 -47.44 84.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.108 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.558 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.3 tp10 -87.06 -3.19 59.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.191 -176.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 59.3 27.85 17.02 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.726 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 35.0 m -124.43 134.42 53.08 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.116 0.484 . . . . 0.0 111.231 -171.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . 0.475 HD12 ' HB2' ' B' ' 100' ' ' HIS . 37.5 tp -103.6 123.13 46.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.098 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.531 ' CE1' HD12 ' B' ' 101' ' ' ILE . 14.8 m-85 -103.83 124.43 48.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.894 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.54 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.9 mm -112.23 120.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.619 175.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.475 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.3 m-85 -118.63 125.87 50.7 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.511 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 71.7 mt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.642 -0.694 . . . . 0.0 109.986 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.76 155.33 70.38 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.629 2.219 . . . . 0.0 111.218 177.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -124.51 9.71 8.44 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 23.7 mmt -91.35 -177.76 4.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.041 0.448 . . . . 0.0 111.039 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 p -134.26 141.25 46.92 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.684 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.09 164.32 34.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.349 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.03 153.75 24.18 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD13 ' B' ' 98' ' ' ILE . 5.2 mm -118.74 128.24 26.08 Favored Pre-proline 0 C--N 1.307 -1.25 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.413 -174.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.98 135.07 24.63 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.452 2.102 . . . . 0.0 111.939 177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.6 p -113.64 130.81 67.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.173 0.511 . . . . 0.0 110.566 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.521 HG11 ' CD2' ' B' ' 99' ' ' PHE . 4.0 p -86.22 149.03 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.512 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.571 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 34.6 mt-10 -115.81 94.46 4.69 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.595 0.712 . . . . 0.0 110.225 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 m -114.16 179.72 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.492 -177.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -95.62 -24.9 16.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.365 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -168.36 163.0 12.78 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.415 176.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.4 mt -83.48 154.02 65.57 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-O 121.066 0.46 . . . . 0.0 111.674 -175.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 165.93 31.13 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.894 2.396 . . . . 0.0 111.428 176.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.54 136.36 57.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.341 -179.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -4.75 29.99 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.817 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -111.13 139.01 46.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.376 0.608 . . . . 0.0 111.856 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.405 ' HB2' ' HH ' ' B' ' 46' ' ' TYR . 17.1 t70 -93.74 94.69 8.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.81 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.614 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 31.6 ttp85 -97.49 145.72 25.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.27 0.557 . . . . 0.0 111.54 -175.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 C--O 1.248 1.0 0 CA-C-N 115.216 -0.902 . . . . 0.0 108.996 176.376 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo . . . . . 0 N--CA 1.481 0.749 0 N-CA-C 110.747 -0.52 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -166.13 -46.05 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.172 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -100.81 117.08 34.17 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.007 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -82.45 -177.67 6.77 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.056 0.455 . . . . 0.0 111.278 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -59.38 166.55 2.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.788 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -107.33 -8.93 16.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.604 177.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.35 -20.81 46.89 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.688 177.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -56.47 122.62 51.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.083 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -66.56 129.61 21.63 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.575 2.183 . . . . 0.0 111.973 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -106.47 96.87 6.77 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.393 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.8 m-85 -86.04 157.68 20.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.497 -177.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.417 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 36.8 tt0 -131.51 119.18 21.19 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 171.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.79 136.32 27.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.466 -175.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -130.88 146.41 52.3 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 176.652 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.531 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.6 OUTLIER -124.75 136.64 54.04 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -177.332 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.463 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.1 tmtp? -136.58 129.49 30.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.742 0.306 . . . . 0.0 110.185 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.467 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 6.7 mpt_? -97.11 134.3 40.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.023 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.463 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.0 m-85 -114.2 164.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.454 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -144.35 119.23 9.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.784 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.72 43.79 93.56 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.804 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -124.56 171.35 10.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -19.24 65.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.293 0.568 . . . . 0.0 110.688 178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.474 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.04 136.36 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.228 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.524 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -87.68 -25.1 23.66 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.09 0.472 . . . . 0.0 110.041 -173.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.531 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.17 138.9 35.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.642 -178.215 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.498 ' N ' HD12 ' B' ' 48' ' ' LEU . 33.1 ttp180 -122.97 119.9 31.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.709 175.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.504 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.0 mp -113.64 128.06 70.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.545 HD13 ' CE2' ' B' ' 108' ' ' TYR . 3.4 mm? -110.68 117.46 33.53 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.082 -178.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -124.06 103.99 13.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.6 pt-20 -108.36 149.28 28.91 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.484 -178.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.62 113.0 24.53 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.768 -177.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -133.51 93.95 3.23 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.508 0.67 . . . . 0.0 110.74 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.436 ' HB2' ' HD2' ' B' ' 57' ' ' PRO . . . -136.09 161.59 61.61 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.807 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.436 ' HD2' ' HB2' ' B' ' 56' ' ' ALA . 11.9 Cg_endo -55.5 -45.16 41.78 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.223 1.948 . . . . 0.0 111.553 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -136.69 64.1 1.55 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.035 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 1.5 m -64.23 110.99 2.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.477 -176.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.417 ' HB2' ' HZ2' ' B' ' 60' ' ' LYS . 9.2 mtmp? -138.92 78.04 30.69 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.625 175.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.94 149.59 90.24 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.601 2.201 . . . . 0.0 112.001 -178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -73.89 -38.21 64.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.68 -178.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -172.03 169.07 5.73 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.415 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -122.18 108.07 12.88 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 168.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.2 m -137.41 80.18 33.99 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-O 120.917 0.389 . . . . 0.0 110.096 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.482 ' C ' ' HG ' ' B' ' 67' ' ' SER . 74.3 Cg_endo -78.95 150.02 23.17 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.587 2.192 . . . . 0.0 111.948 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.482 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 9.6 m -154.65 150.05 27.25 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.426 -178.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.446 ' HB2' HD21 ' B' ' 75' ' ' LEU . 61.9 t80 -115.08 124.43 51.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.365 0.603 . . . . 0.0 111.19 -176.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.417 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.2 p-10 -105.03 113.43 27.02 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.389 174.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . 0.405 ' CD2' ' HE2' ' B' ' 68' ' ' TYR . 88.1 m-85 -63.9 -32.82 74.48 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.907 -176.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.73 70.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.727 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.516 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -109.9 2.98 20.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.208 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.83 44.7 18.31 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.477 1.11 . . . . 0.0 111.36 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.516 HG13 ' O ' ' B' ' 72' ' ' GLU . 61.6 mt -121.49 134.16 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.484 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.451 HD11 ' C ' ' B' ' 75' ' ' LEU . 3.4 tm? -101.95 107.09 18.13 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 176.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.38 140.61 29.41 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 41.2 mm -91.63 -59.62 2.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.051 0.453 . . . . 0.0 110.655 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.416 ' C ' ' H ' ' B' ' 80' ' ' LYS . 55.9 m-20 -149.68 -179.48 7.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.326 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.12 6.44 7.1 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.244 177.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . 0.416 ' H ' ' C ' ' B' ' 78' ' ' ASN . 25.9 mmmt -94.43 -43.41 8.38 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.527 HD13 ' O ' ' B' ' 81' ' ' LEU . 1.6 pp -157.82 153.72 26.89 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.708 -177.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 41.3 t -130.12 149.06 51.99 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.683 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.1 mm -112.6 105.77 55.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.897 0.38 . . . . 0.0 111.104 -174.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -79.04 136.86 13.3 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.352 2.034 . . . . 0.0 112.416 177.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.46 156.08 35.6 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.284 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . 0.403 ' HG2' HD11 ' B' ' 89' ' ' ILE . 31.9 Cg_endo -64.92 141.06 69.29 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.31 2.007 . . . . 0.0 111.492 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.519 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 8.4 mpt_? -80.1 1.81 26.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.778 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.5 -20.28 28.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.286 0.565 . . . . 0.0 109.974 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.403 HD11 ' HG2' ' B' ' 86' ' ' PRO . 62.2 mt -103.99 134.61 44.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.601 -174.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.6 t -84.17 110.13 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.696 177.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 45.2 t -111.78 132.56 60.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.499 -175.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.583 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.78 161.15 38.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.78 178.757 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.29 -18.0 63.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.699 -176.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.65 -12.36 54.08 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.583 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 21.9 t70 -110.99 -24.04 10.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.097 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 84.6 mt -71.42 113.43 7.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.197 178.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.5 mmmt -109.54 105.7 15.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.93 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.405 HD13 ' HB ' ' A' ' 8' ' ' ILE . 57.0 mt -109.73 121.87 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.073 0.463 . . . . 0.0 111.69 -177.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . 0.521 ' CD2' HG11 ' A' ' 11' ' ' VAL . 88.3 m-85 -129.07 118.41 22.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.627 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.571 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 19.9 t-80 -99.39 106.66 18.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.097 0.475 . . . . 0.0 109.859 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.581 HD13 ' CE1' ' B' ' 108' ' ' TYR . 70.4 mt -87.24 115.24 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.698 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' B' ' 102' ' ' ARG . 33.2 mtp85 -77.25 -19.31 56.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.399 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -57.63 -48.56 79.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.767 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.482 ' H ' HG22 ' B' ' 101' ' ' ILE . 63.1 mm-40 -106.85 0.28 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.707 -179.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 54.07 40.54 31.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.83 -172.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.416 HG21 ' HB3' ' B' ' 53' ' ' GLU . 50.7 m -119.65 137.35 53.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.815 -174.257 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.75 119.6 39.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.424 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.614 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 24.5 m-85 -101.81 123.01 45.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.732 178.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.504 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.9 mm -113.19 119.44 60.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.947 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.42 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 88.8 m-85 -118.84 128.69 54.69 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.474 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.2 mt . . . . . 0 C--O 1.243 0.754 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.352 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.793 0 N-CA-C 111.934 -0.466 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.73 -32.63 95.96 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 123.061 2.507 . . . . 0.0 112.773 -177.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -138.05 33.97 2.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.642 0.734 . . . . 0.0 109.511 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 13.8 tpt -58.88 125.43 23.52 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.738 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.442 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.0 p -153.46 144.51 22.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.592 -175.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -128.53 144.19 38.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.669 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.76 137.33 33.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.904 0.383 . . . . 0.0 110.004 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.4 mm -108.05 120.31 47.29 Favored Pre-proline 0 C--N 1.316 -0.849 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.13 127.7 16.37 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.23 1.953 . . . . 0.0 112.178 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.2 p -102.46 127.12 56.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.381 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.465 HG13 HG12 ' A' ' 13' ' ' VAL . 47.8 t -95.02 125.73 47.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.056 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.46 ' OE1' ' HD2' ' B' ' 102' ' ' ARG . 44.3 mt-10 -90.55 107.04 18.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.215 0.531 . . . . 0.0 110.253 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.663 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 11.0 m -126.63 177.4 5.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.357 -179.221 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -98.64 -16.97 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.008 0.432 . . . . 0.0 110.03 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -170.52 159.1 6.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.574 178.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.434 HD22 ' HB2' ' A' ' 22' ' ' ARG . 2.5 mm? -76.83 150.72 81.77 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.08 172.83 13.14 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.272 1.981 . . . . 0.0 111.634 174.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.52 139.51 58.23 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.139 0.495 . . . . 0.0 111.004 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.83 -15.0 37.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.132 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -95.35 166.71 11.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.89 0.376 . . . . 0.0 111.427 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.46 ' CB ' ' HH ' ' B' ' 46' ' ' TYR . 15.3 t70 -123.41 96.25 4.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.46 -177.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.434 ' HB2' HD22 ' A' ' 16' ' ' LEU . 22.5 ttp85 -100.1 145.3 28.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.125 178.021 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.6 m . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.814 -179.699 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo . . . . . 0 N--CA 1.477 0.505 0 N-CA-C 110.454 -0.633 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -86.37 79.67 8.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.217 0.532 . . . . 0.0 110.282 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -96.05 160.58 14.38 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.946 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -116.85 142.56 46.77 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 121.014 0.435 . . . . 0.0 110.512 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . 0.442 ' H ' ' CG2' ' B' ' 31' ' ' VAL . 76.3 mm-40 -133.61 -166.96 1.86 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.994 178.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -83.75 -29.98 27.02 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.007 177.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -67.34 -20.68 65.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.482 -179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.442 ' CG2' ' H ' ' B' ' 28' ' ' GLN . 59.8 t -69.8 118.58 64.49 Favored Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-N 115.23 -0.895 . . . . 0.0 111.08 -176.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.538 ' HA ' ' HB3' ' B' ' 59' ' ' SER . 32.7 Cg_endo -67.84 130.82 22.63 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.878 2.385 . . . . 0.0 113.143 -179.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.584 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 39.0 tt0 -91.28 98.18 11.56 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.65 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -83.82 157.2 22.13 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.014 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -133.12 119.59 20.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.009 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.401 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.6 t -96.09 133.52 37.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.888 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.462 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.02 120.58 27.79 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.53 ' HG2' HD12 ' B' ' 48' ' ' LEU . 2.2 ttt -105.09 145.93 29.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.497 0.189 . . . . 0.0 110.614 -174.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.48 132.89 18.59 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -176.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.432 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.59 136.41 36.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.101 0.477 . . . . 0.0 110.86 179.702 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -117.57 167.65 11.12 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.363 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -156.59 109.43 2.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.938 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.4 11.85 46.85 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.305 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -111.69 171.59 7.4 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.15 -24.77 63.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.354 0.597 . . . . 0.0 110.706 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.624 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.4 p90 -124.42 142.75 51.06 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.859 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.478 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -102.04 -18.55 15.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.98 -175.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.559 HD11 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -140.23 132.93 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.823 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -119.67 120.32 36.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 177.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.559 ' CD1' HD11 ' B' ' 48' ' ' LEU . 2.0 mp -118.05 129.21 74.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.489 HD12 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.03 114.58 26.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.188 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.43 103.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -110.33 152.92 25.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.262 0.554 . . . . 0.0 111.118 -176.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . 0.434 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -94.6 113.35 25.15 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.053 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -137.94 91.48 2.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.171 0.51 . . . . 0.0 110.467 176.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.584 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -138.67 162.2 54.3 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.016 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.432 ' HD2' ' HB3' ' B' ' 56' ' ' ALA . 36.3 Cg_endo -67.85 -43.04 5.62 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.136 1.891 . . . . 0.0 112.677 176.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 29.3 m-80 -128.31 36.35 4.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.052 0.453 . . . . 0.0 111.552 -171.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.538 ' HB3' ' HA ' ' B' ' 32' ' ' PRO . 1.1 p -72.1 124.93 26.03 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.097 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -132.38 75.28 74.4 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.844 175.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.34 143.04 62.36 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.852 2.368 . . . . 0.0 112.599 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -85.66 -72.12 0.5 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.858 178.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -156.81 -172.45 4.05 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.569 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -135.86 131.18 34.98 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.319 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.7 m -137.09 79.23 38.39 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-O 121.164 0.507 . . . . 0.0 109.829 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.431 ' C ' ' HG ' ' B' ' 67' ' ' SER . 61.3 Cg_endo -76.27 153.0 35.55 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.865 2.377 . . . . 0.0 112.668 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.431 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 14.9 m -153.91 147.33 24.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.138 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.481 ' HH ' HG13 ' B' ' 91' ' ' VAL . 34.9 t80 -103.92 120.73 41.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.304 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.517 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.8 p-10 -100.2 112.38 24.7 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.386 176.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -63.1 -33.21 74.95 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.595 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.13 77.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.875 -175.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.49 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -112.45 3.4 16.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.257 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . 0.453 HD22 ' NE ' ' B' ' 87' ' ' ARG . 2.2 p-10 47.05 45.77 15.85 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.38 1.072 . . . . 0.0 111.616 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.517 ' HB ' HD22 ' B' ' 69' ' ' ASN . 63.7 mt -121.4 139.29 48.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.065 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -102.22 102.54 12.96 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.0 140.88 29.42 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -177.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -94.75 -54.43 7.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.469 -177.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -149.64 178.79 8.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.49 6.6 15.87 Favored Glycine 0 CA--C 1.517 0.184 0 C-N-CA 120.659 -0.781 . . . . 0.0 111.939 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -96.21 -37.3 10.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.49 . . . . 0.0 110.066 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.46 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.6 OUTLIER -158.01 151.92 24.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 112.094 178.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.0 p -128.78 148.72 50.88 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.67 177.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.5 mm -105.86 104.25 48.09 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.896 0.379 . . . . 0.0 110.391 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.51 ' HA ' HG12 ' B' ' 74' ' ' ILE . 61.4 Cg_endo -75.48 131.76 14.1 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.245 1.963 . . . . 0.0 112.211 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 54.0 mt -101.32 146.5 32.3 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.237 -175.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.65 142.85 65.82 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.276 1.984 . . . . 0.0 111.4 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.453 ' NE ' HD22 ' B' ' 73' ' ' ASN . 9.2 mpt_? -78.24 1.01 22.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.533 -175.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -93.28 -1.4 56.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.579 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 60.0 mt -116.73 137.92 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 67.1 t -87.03 113.02 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . 0.481 HG13 ' HH ' ' B' ' 68' ' ' TYR . 1.6 p -125.27 132.49 71.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.311 0.577 . . . . 0.0 111.393 -174.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.464 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -142.37 163.64 32.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.028 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.23 63.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.67 -13.4 51.59 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.464 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 31.3 t70 -111.28 -21.19 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.111 -175.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.0 mt -75.73 118.56 22.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.169 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.442 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.1 mmmt -111.98 107.72 16.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.114 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 53.4 mt -111.42 121.43 63.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.983 0.421 . . . . 0.0 111.364 -178.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -132.66 122.53 24.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.205 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.417 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 45.3 t60 -102.86 110.7 22.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.998 0.428 . . . . 0.0 110.752 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.663 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 56.1 mt -91.16 114.18 28.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.195 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . 0.46 ' HD2' ' OE1' ' A' ' 12' ' ' GLU . 39.5 mtp85 -81.06 -26.09 36.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.126 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.4 tttp -58.55 -42.31 87.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.337 177.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.571 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.6 tp10 -105.29 1.7 28.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.306 0.574 . . . . 0.0 110.002 -177.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 55.47 31.47 17.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.903 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 37.2 m -123.49 139.95 53.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 121.015 0.436 . . . . 0.0 110.939 -173.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.53 121.32 44.05 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.799 178.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.618 ' CE1' HD12 ' B' ' 101' ' ' ILE . 8.4 m-85 -100.42 126.36 46.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.245 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.514 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 39.0 mm -115.94 117.73 56.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.732 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.442 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 87.3 m-85 -119.01 123.04 43.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.624 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 68.1 mt . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.745 -0.645 . . . . 0.0 109.807 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.722 0 N-CA-C 111.846 -0.502 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.78 63.14 4.82 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.902 2.401 . . . . 0.0 112.39 179.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.51 ' O ' ' HB2' ' A' ' 4' ' ' MET . 37.8 t-80 -150.62 154.06 36.81 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.628 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.51 ' HB2' ' O ' ' A' ' 3' ' ' HIS . 46.9 mmm 76.8 161.67 0.23 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.886 0.741 . . . . 0.0 112.094 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.465 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 39.2 p -129.93 137.63 50.46 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.73 176.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.0 m -120.66 140.1 45.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.013 -179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.54 139.45 30.84 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.768 -179.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.1 mm -112.13 119.6 43.67 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -70.54 128.73 15.71 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.236 1.957 . . . . 0.0 112.105 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.0 t -83.58 135.45 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.135 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.493 HG13 HG13 ' A' ' 13' ' ' VAL . 38.6 t -99.18 111.07 27.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.5 ' OE1' ' HD3' ' B' ' 102' ' ' ARG . 45.1 mt-10 -85.9 102.21 13.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 0.0 110.605 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.493 HG13 HG13 ' A' ' 11' ' ' VAL . 5.8 m -123.16 -176.46 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.072 -178.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -94.43 -29.96 14.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -162.61 162.93 27.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.534 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.429 HD21 ' HB2' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -81.72 143.45 50.61 Favored Pre-proline 0 N--CA 1.448 -0.539 0 CA-C-O 120.776 0.322 . . . . 0.0 110.817 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -51.62 171.0 0.16 Allowed 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 123.931 3.087 . . . . 0.0 113.469 174.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -65.59 141.13 58.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.494 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.48 -4.6 60.09 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.493 -0.861 . . . . 0.0 111.22 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.71 164.76 11.72 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.48 94.36 4.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.042 0.449 . . . . 0.0 111.563 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.429 ' HB2' HD21 ' A' ' 16' ' ' LEU . 13.4 ttp180 -101.33 147.53 26.21 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.8 t . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.238 -175.831 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo . . . . . 0 N--CA 1.481 0.755 0 N-CA-C 110.254 -0.71 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -160.03 146.61 15.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 60.9 71.68 0.55 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.543 0.687 . . . . 0.0 110.287 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -118.94 149.91 40.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.561 -175.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -83.54 157.63 22.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.683 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -98.2 -6.37 31.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.684 -178.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . 0.418 ' HA ' ' HB2' ' B' ' 58' ' ' ASN . 4.6 m-20 -92.28 3.11 56.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.242 179.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -66.43 116.49 34.57 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.073 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.97 130.29 28.66 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.56 2.173 . . . . 0.0 112.783 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.403 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.1 tt0 -111.15 103.0 11.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.191 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.504 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.8 m-85 -86.39 156.51 20.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.602 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.522 ' OE2' ' HE2' ' B' ' 37' ' ' LYS . 35.0 tt0 -129.24 118.64 22.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.506 -0.77 . . . . 0.0 108.983 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -94.29 133.88 33.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.412 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.522 ' HE2' ' OE2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -128.84 145.41 51.21 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.382 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.483 ' HG2' HD13 ' B' ' 48' ' ' LEU . 1.5 ttt -125.68 138.38 53.89 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.442 -178.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.591 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 6.6 tmtm? -142.13 135.12 28.74 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -173.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.433 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 7.7 mpt_? -99.07 133.33 43.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.813 0.339 . . . . 0.0 111.122 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.591 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 45.8 m-85 -118.44 150.79 38.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.619 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -134.39 120.94 20.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.642 177.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.36 26.49 51.54 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.578 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.22 171.81 8.03 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -20.53 65.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.335 0.588 . . . . 0.0 110.391 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.573 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -126.38 142.01 51.69 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.518 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.6 mppt? -101.81 -21.53 14.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.498 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.76 130.52 25.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.899 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -116.11 129.73 56.47 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.498 ' CD1' HD12 ' B' ' 48' ' ' LEU . 2.7 mp -122.06 130.64 74.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.532 HD12 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -116.47 123.59 47.86 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.277 -176.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.7 mp -125.61 103.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.545 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.504 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.1 pt-20 -108.38 153.6 23.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.949 0.404 . . . . 0.0 110.191 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.18 113.6 25.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.662 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -135.65 93.19 2.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.6 0.714 . . . . 0.0 110.318 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.514 ' HB3' ' HD2' ' B' ' 57' ' ' PRO . . . -137.24 167.52 20.47 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.48 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.514 ' HD2' ' HB3' ' B' ' 56' ' ' ALA . 11.0 Cg_endo -54.54 -42.32 69.22 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.358 2.039 . . . . 0.0 111.419 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . 0.418 ' HB2' ' HA ' ' B' ' 30' ' ' ASP . 28.1 m-80 -137.38 77.8 1.66 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.618 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 4.6 m -75.42 111.87 11.15 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.796 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -132.44 71.26 79.34 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.197 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -72.04 143.64 40.9 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.133 1.889 . . . . 0.0 110.908 174.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -113.0 -67.64 0.99 Allowed 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.13 -175.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.07 163.76 20.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.191 0.52 . . . . 0.0 110.927 177.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -132.17 127.77 36.59 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.302 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.2 m -130.58 78.81 73.35 Favored Pre-proline 0 C--N 1.318 -0.769 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.208 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.466 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 94.8 Cg_endo -84.54 156.02 12.23 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.557 2.171 . . . . 0.0 112.492 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.8 p -162.11 139.67 8.56 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.112 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.419 ' HB2' HD21 ' B' ' 75' ' ' LEU . 60.7 t80 -104.34 128.05 52.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.436 -178.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.513 HD22 ' HB2' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -105.37 132.59 51.37 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -79.61 -25.74 41.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.499 -178.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.66 -51.11 66.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.143 0.496 . . . . 0.0 110.841 -175.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.513 ' HB2' HD22 ' B' ' 69' ' ' ASN . 2.4 mt-10 -104.68 -3.39 23.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.15 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . 0.481 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 2.3 p-10 57.74 43.67 21.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.088 0.947 . . . . 0.0 110.909 173.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.413 HG13 ' O ' ' B' ' 72' ' ' GLU . 62.4 mt -119.84 134.28 63.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.14 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.419 HD21 ' HB2' ' B' ' 68' ' ' TYR . 2.6 tm? -105.48 103.3 12.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.971 178.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.466 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -91.43 146.56 23.7 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.54 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 40.3 mm -99.01 -51.86 9.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.481 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.477 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.9 m-20 -155.67 179.48 9.15 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.31 33.92 1.12 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.381 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . 0.477 ' H ' ' C ' ' B' ' 78' ' ' ASN . 31.5 mmtp -124.12 -42.04 2.17 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.475 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.7 OUTLIER -155.23 153.39 30.58 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.802 -178.191 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 54.9 p -127.69 141.76 51.52 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.231 179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -104.67 104.65 46.78 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-O 120.815 0.34 . . . . 0.0 110.63 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.05 132.9 8.65 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 122.213 1.942 . . . . 0.0 111.942 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -95.58 147.36 32.88 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.892 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . 0.411 ' HG2' HD13 ' B' ' 89' ' ' ILE . 34.8 Cg_endo -66.11 139.02 54.15 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.188 1.926 . . . . 0.0 111.396 176.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.02 -5.13 39.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.553 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.89 -20.09 58.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.842 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.411 HD13 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -111.67 137.26 45.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.446 -176.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 6.4 p -88.57 122.71 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 47.5 t -122.55 136.09 60.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.723 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.54 164.15 30.99 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.763 176.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.04 -22.37 66.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.144 0.497 . . . . 0.0 111.197 -176.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -11.88 57.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.867 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.723 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 15.5 t70 -105.18 -25.06 12.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.511 -177.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 72.0 mt -75.66 119.13 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.433 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm -113.23 100.34 8.5 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.753 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 45.3 mt -104.44 118.43 51.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 121.026 0.441 . . . . 0.0 111.211 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -129.8 119.02 22.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.574 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.425 ' HB2' HD12 ' B' ' 107' ' ' LEU . 85.2 t60 -101.57 121.49 42.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.81 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.46 HG22 ' H ' ' B' ' 104' ' ' GLU . 76.9 mt -101.86 116.2 45.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.463 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . 0.5 ' HD3' ' OE1' ' A' ' 12' ' ' GLU . 21.4 mtm180 -81.2 -39.77 24.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.647 -174.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.41 -32.54 71.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.337 0.589 . . . . 0.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.46 ' H ' HG22 ' B' ' 101' ' ' ILE . 32.6 tt0 -101.36 -5.47 25.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.129 -178.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 34.5 mtm180 51.03 37.77 18.76 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.766 -1.107 . . . . 0.0 111.779 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 45.7 m -128.41 139.68 52.23 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.797 -175.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' B' ' 100' ' ' HIS . 52.5 tp -111.19 117.19 32.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.532 ' CE2' HD12 ' B' ' 51' ' ' LEU . 44.0 m-85 -98.62 124.5 43.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.322 -178.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.43 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 45.0 mm -113.11 117.01 54.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.108 178.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.473 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 72.8 m-85 -118.71 127.66 53.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 177.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.573 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 64.1 mt . . . . . 0 C--O 1.248 1.013 0 CA-C-O 119.035 -0.507 . . . . 0.0 109.778 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.866 -0.494 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -63.81 -66.0 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.581 2.187 . . . . 0.0 111.404 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -128.95 -79.96 0.57 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 175.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 39.3 tpp 65.27 124.15 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 122.066 0.936 . . . . 0.0 112.075 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 21.2 p -139.81 129.63 24.67 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.03 179.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.416 ' CG2' ' HB3' ' B' ' 93' ' ' ALA . 16.4 m -116.76 136.61 53.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.448 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.8 138.11 31.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -176.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.422 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.13 121.11 42.62 Favored Pre-proline 0 C--N 1.319 -0.751 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.351 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.91 135.54 23.54 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 122.58 2.187 . . . . 0.0 112.482 178.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.428 HG12 HG23 ' B' ' 98' ' ' ILE . 26.0 t -98.8 134.75 36.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.982 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.499 ' O ' HG12 ' A' ' 11' ' ' VAL . 3.6 p -89.6 148.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.517 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -115.27 94.22 4.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.733 0.778 . . . . 0.0 110.237 170.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.1 m -115.43 -171.75 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.358 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -99.19 -30.75 12.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -153.82 178.05 10.33 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.406 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.41 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -84.6 149.36 54.18 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.393 173.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.427 ' HG2' ' CE1' ' A' ' 20' ' ' TYR . 39.7 Cg_endo -68.94 165.21 30.76 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.046 1.831 . . . . 0.0 111.472 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.05 135.41 56.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.097 0.475 . . . . 0.0 110.869 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.46 -5.27 29.77 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.815 -174.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.427 ' CE1' ' HG2' ' A' ' 17' ' ' PRO . 65.0 m-85 -106.35 176.8 5.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 0.0 111.318 177.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -131.54 97.35 4.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.538 -178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.584 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 64.3 ttp85 -93.82 145.98 24.21 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.501 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.6 t . . . . . 0 C--O 1.245 0.866 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 178.997 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.48 0.721 0 N-CA-C 111.44 -0.254 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -91.46 -62.39 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 58.38 -158.48 0.29 Allowed 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.791 0.682 . . . . 0.0 111.293 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -83.29 164.93 19.76 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 175.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.03 153.44 43.78 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.445 0.641 . . . . 0.0 111.021 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' B' ' 58' ' ' ASN . 11.5 pt-20 -85.21 -20.43 30.17 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.361 -177.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . 0.571 ' HA ' ' O ' ' B' ' 58' ' ' ASN . 5.1 p-10 -87.05 -2.48 58.66 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.163 -178.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.76 119.01 50.7 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.437 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.95 129.12 16.86 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.413 2.075 . . . . 0.0 111.645 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.432 ' H ' ' HB1' ' B' ' 56' ' ' ALA . 33.7 tt0 -102.55 98.09 8.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.489 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.9 m-85 -83.11 148.17 27.66 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.753 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -120.37 114.66 22.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.283 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 82.8 t -94.62 125.22 47.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.503 -178.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -123.23 142.49 50.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.204 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.504 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.5 OUTLIER -127.4 137.83 52.84 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 121.169 -0.212 . . . . 0.0 110.552 -174.504 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.497 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.5 tmtt? -145.58 132.9 20.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.653 0.263 . . . . 0.0 110.362 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.497 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -93.09 139.56 30.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.358 -177.835 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.432 ' CE2' ' HE1' ' B' ' 46' ' ' TYR . 23.9 m-85 -121.49 167.67 12.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.31 176.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -156.4 112.0 2.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.075 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 97.66 16.81 32.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.056 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.09 172.09 7.27 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.7 -18.91 63.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.114 0.483 . . . . 0.0 110.87 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.556 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 2.4 p90 -130.69 147.85 52.41 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.518 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.43 -20.07 14.19 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.203 0.525 . . . . 0.0 109.806 -177.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.504 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -136.23 133.52 37.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.498 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.7 ttp180 -115.83 115.6 26.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.405 176.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.549 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -114.64 131.86 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.543 HD11 ' CD2' ' B' ' 108' ' ' TYR . 4.2 mm? -115.23 122.91 47.44 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.989 -178.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.63 103.46 11.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 176.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.489 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.8 pt-20 -113.05 153.42 28.16 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.072 0.463 . . . . 0.0 110.477 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . 0.423 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -96.37 110.05 22.46 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.885 -177.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -135.67 93.17 2.91 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.509 0.671 . . . . 0.0 110.775 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.491 ' HB2' ' HD2' ' B' ' 57' ' ' PRO . . . -136.29 163.81 47.38 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.26 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.491 ' HD2' ' HB2' ' B' ' 56' ' ' ALA . 18.0 Cg_endo -57.53 -43.1 54.11 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.29 1.993 . . . . 0.0 111.973 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . 0.571 ' O ' ' HA ' ' B' ' 30' ' ' ASP . 29.0 m-80 -136.72 68.94 1.42 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.974 -178.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 7.5 m -71.08 121.6 18.55 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.208 -175.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -133.04 73.09 75.78 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.026 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.69 145.62 95.07 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.78 2.32 . . . . 0.0 112.043 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -92.73 -59.36 2.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.046 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -163.43 178.87 7.72 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.546 -176.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -134.44 117.34 16.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.642 174.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 38.7 m -133.55 78.8 61.41 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-O 121.009 0.433 . . . . 0.0 110.104 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.588 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 93.2 Cg_endo -82.09 150.89 15.93 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.569 2.179 . . . . 0.0 112.193 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.496 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 15.1 m -158.33 144.71 17.31 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.125 -179.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.455 ' CZ ' HG12 ' B' ' 91' ' ' VAL . 45.2 t80 -102.71 118.3 36.54 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.615 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.401 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.1 p-10 -101.18 115.84 31.42 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.753 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -63.8 -26.26 68.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.619 -178.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.13 63.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.784 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.585 ' O ' HG13 ' B' ' 74' ' ' ILE . 11.2 mt-10 -112.08 2.44 16.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.16 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 47.69 46.02 18.12 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.54 1.15 . . . . 0.0 110.811 -174.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.585 HG13 ' O ' ' B' ' 72' ' ' GLU . 84.7 mt -120.85 137.09 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.097 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.406 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.3 tm? -100.11 100.71 11.61 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 177.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.588 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -87.82 137.61 32.19 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.597 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.2 mm -89.79 -49.11 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.403 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -151.59 -177.57 6.18 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.55 0.96 54.03 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.238 -0.982 . . . . 0.0 111.918 176.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -94.25 -34.77 12.74 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.81 0.338 . . . . 0.0 110.411 -176.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.436 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.4 OUTLIER -157.0 152.39 26.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.802 178.041 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' SER . . . . . 0.446 ' O ' ' HD3' ' B' ' 84' ' ' PRO . 35.8 p -128.45 150.0 50.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.105 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -107.77 98.82 26.65 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-O 120.821 0.344 . . . . 0.0 110.553 -179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.559 ' HA ' HG12 ' B' ' 74' ' ' ILE . 14.5 Cg_exo -70.53 135.95 29.81 Favored 'Trans proline' 0 CA--C 1.515 -0.429 0 C-N-CA 122.558 2.172 . . . . 0.0 112.127 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.03 147.84 35.17 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.257 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . 0.407 ' HG2' HD11 ' B' ' 89' ' ' ILE . 36.8 Cg_endo -66.96 139.27 50.8 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.251 1.967 . . . . 0.0 111.64 178.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -7.72 52.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.683 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -80.41 -13.74 58.89 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.636 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.407 HD11 ' HG2' ' B' ' 86' ' ' PRO . 61.1 mt -113.9 133.44 59.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.058 -174.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 8.8 p -83.94 125.57 40.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.464 176.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . 0.455 HG12 ' CZ ' ' B' ' 68' ' ' TYR . 2.3 p -137.23 137.45 46.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 111.447 -174.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.613 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -139.73 165.62 26.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.618 177.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . 0.416 ' HB3' ' CG2' ' A' ' 6' ' ' VAL . . . -59.54 -25.89 64.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.291 0.567 . . . . 0.0 111.237 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.95 -12.98 59.29 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.613 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 23.0 t0 -106.01 -22.57 12.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 0.0 109.639 -177.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 75.4 mt -76.39 117.11 20.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.417 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.9 mmmt -110.96 109.45 19.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.157 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.428 HG23 HG12 ' A' ' 10' ' ' VAL . 50.8 mt -113.48 118.01 57.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 121.206 0.526 . . . . 0.0 111.401 -178.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . 0.496 ' CD2' HG13 ' A' ' 11' ' ' VAL . 73.7 m-85 -128.06 117.67 22.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.475 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.517 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 20.6 t-80 -98.96 110.08 22.74 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.027 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.575 HG23 ' H ' ' B' ' 104' ' ' GLU . 3.7 mp -91.82 109.05 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -81.08 -17.74 49.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.593 -174.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -70.07 -47.61 61.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.14 0.495 . . . . 0.0 110.076 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.575 ' H ' HG23 ' B' ' 101' ' ' ILE . 18.5 mm-40 -86.71 -1.8 58.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.256 177.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 53.02 38.5 27.46 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.576 -176.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 40.1 m -125.88 128.12 47.09 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.099 0.476 . . . . 0.0 110.956 -173.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . 0.405 HD12 ' CG2' ' B' ' 98' ' ' ILE . 45.1 tp -98.9 112.57 24.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.907 177.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.584 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 61.2 m-85 -91.99 123.13 35.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.952 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.549 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.7 mm -112.12 124.9 69.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.961 177.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.475 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 87.8 m-85 -126.9 123.73 37.91 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.457 -0.783 . . . . 0.0 110.109 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.623 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.86 129.84 13.87 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.793 2.329 . . . . 0.0 112.135 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -56.04 -32.79 64.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.32 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 43.9 tpp -148.33 131.17 16.1 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.166 0.507 . . . . 0.0 110.33 174.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p -152.49 137.69 17.43 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.795 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.6 m -130.18 148.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.886 0.374 . . . . 0.0 110.569 -178.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.429 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -92.3 138.96 31.08 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.6 mm -107.73 122.95 39.34 Favored Pre-proline 0 C--N 1.32 -0.677 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.467 -176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.11 129.02 15.55 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.293 1.995 . . . . 0.0 112.015 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.4 p -104.67 135.3 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.311 0.577 . . . . 0.0 110.869 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.485 HG11 ' CD2' ' B' ' 99' ' ' PHE . 3.5 p -86.53 148.8 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.632 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 44.2 mt-10 -115.23 93.75 4.43 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.565 0.698 . . . . 0.0 110.047 170.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.482 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 12.6 m -116.06 -173.44 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.938 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.54 -22.48 16.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.569 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -169.98 172.95 6.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.395 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.411 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -76.13 150.53 83.22 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.38 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.4 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 51.1 Cg_endo -71.64 172.91 13.42 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 121.948 1.765 . . . . 0.0 111.968 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -53.52 138.53 33.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.315 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.29 -9.61 53.89 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.64 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.4 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 60.7 m-85 -99.92 143.07 30.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 0.0 111.969 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -96.2 95.58 8.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.619 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.452 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 18.2 ttt180 -92.1 149.06 21.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.702 -175.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 C--O 1.251 1.156 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.261 173.597 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.474 0.338 0 N-CA-C 110.479 -0.623 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 7.1 p-80 -76.47 -21.62 55.62 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.069 0.461 . . . . 0.0 110.513 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -96.33 128.54 43.34 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.4 ' O ' HG23 ' B' ' 31' ' ' VAL . 27.6 mt-30 -102.0 144.87 30.07 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.21 -177.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 66.55 157.49 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 O-C-N 124.275 0.985 . . . . 0.0 112.999 177.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -108.92 2.14 21.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.998 177.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -84.19 -13.75 51.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.392 176.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 27' ' ' GLN . 51.8 t -77.2 117.28 64.15 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.535 -170.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.458 ' HA ' ' CB ' ' B' ' 59' ' ' SER . 41.1 Cg_endo -70.38 130.04 17.93 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.475 2.116 . . . . 0.0 112.304 177.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -90.8 97.92 11.47 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.361 177.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -87.56 153.64 21.24 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.496 176.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -125.89 118.18 24.91 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.77 126.87 48.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.869 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.58 119.12 26.29 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.562 ' HG2' HD12 ' B' ' 48' ' ' LEU . 1.2 ttt -101.85 139.64 37.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -144.98 131.65 19.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.769 0.319 . . . . 0.0 110.621 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' B' ' 40' ' ' ARG . 8.6 mmt180 -87.99 143.12 27.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.511 0.672 . . . . 0.0 112.586 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -131.17 152.48 50.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.074 176.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -140.97 116.3 10.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.292 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.98 16.95 58.72 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.148 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.27 172.06 7.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.758 0.313 . . . . 0.0 110.721 -177.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.02 -3.54 16.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.124 0.488 . . . . 0.0 110.864 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.431 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -147.42 140.21 24.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.534 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.1 mppt? -94.28 -23.29 17.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.268 0.556 . . . . 0.0 109.646 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.562 HD12 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -135.74 134.0 38.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.16 179.877 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.518 ' N ' HD13 ' B' ' 48' ' ' LEU . 49.7 ttp180 -116.54 123.01 46.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.476 174.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.517 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.0 mp -119.7 127.83 75.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.508 HD13 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -113.01 118.48 34.94 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -121.81 102.88 12.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 176.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.4 pt-20 -108.79 153.95 22.76 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.353 -178.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -97.67 115.34 27.75 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ptmm? -137.55 91.41 2.59 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.386 176.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.517 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -136.63 153.92 76.26 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.562 172.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -62.5 -38.34 52.74 Favored 'Trans proline' 0 CA--C 1.519 -0.227 0 C-N-CA 122.845 2.363 . . . . 0.0 110.668 172.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -135.48 99.98 4.37 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 114.749 -1.114 . . . . 0.0 108.74 -177.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.517 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 7.5 p -150.25 129.24 12.6 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.708 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.417 ' O ' ' HG3' ' B' ' 60' ' ' LYS . 18.6 ptpt -121.56 78.69 37.77 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.355 -177.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.21 137.63 52.66 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.286 1.991 . . . . 0.0 112.001 176.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -104.14 -59.96 1.65 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.707 -176.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -161.52 171.65 17.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.335 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -124.96 133.89 52.84 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.194 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 49.9 m -134.9 78.96 53.02 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.453 ' C ' ' HG ' ' B' ' 67' ' ' SER . 64.3 Cg_endo -78.93 150.27 23.41 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.609 2.206 . . . . 0.0 112.255 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.453 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 11.4 m -155.86 147.47 22.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.384 -178.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.486 ' HH ' HG11 ' B' ' 91' ' ' VAL . 55.0 t80 -109.8 118.58 36.87 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.709 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.401 HD22 ' HB ' ' B' ' 74' ' ' ILE . 1.4 p-10 -99.14 113.2 25.31 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.482 175.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -62.82 -32.66 73.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.907 -175.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.92 72.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.959 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.459 ' O ' HG13 ' B' ' 74' ' ' ILE . 12.1 mm-40 -112.17 1.06 16.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.198 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 47.47 46.55 17.43 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 124.521 1.138 . . . . 0.0 111.487 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.459 HG13 ' O ' ' B' ' 72' ' ' GLU . 59.3 mt -120.5 136.99 55.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.155 -178.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.438 HD22 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -103.36 101.31 11.22 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.424 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -88.76 143.52 26.86 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -178.575 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 48.1 mm -96.11 -60.89 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.271 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.32 -171.56 3.87 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.72 2.27 41.23 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.105 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -85.63 -45.78 11.39 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.506 0.67 . . . . 0.0 109.344 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.492 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.6 OUTLIER -159.32 153.45 23.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.134 -176.108 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 26.7 p -124.49 148.43 47.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.799 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.73 102.07 36.36 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.804 0.335 . . . . 0.0 110.456 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.456 ' HA ' HG12 ' B' ' 74' ' ' ILE . 57.6 Cg_endo -74.22 131.82 15.75 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.081 1.854 . . . . 0.0 111.708 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.5 mt -102.28 146.76 32.9 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.236 -175.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -69.05 139.86 43.78 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.194 1.929 . . . . 0.0 111.673 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.26 -3.11 24.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.468 -176.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -81.26 -13.28 58.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.2 mt -112.52 134.72 54.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.684 -177.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 95.3 t -87.52 109.23 19.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . 0.486 HG11 ' HH ' ' B' ' 68' ' ' TYR . 2.2 p -119.95 135.79 59.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.255 0.55 . . . . 0.0 111.11 -173.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.466 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -139.82 165.82 26.27 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 179.906 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.89 -20.3 63.59 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.491 0.494 . . . . 0.0 111.682 -176.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.7 -14.12 46.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.466 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 28.7 t0 -105.78 -23.97 12.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.723 0.773 . . . . 0.0 109.768 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.09 117.08 14.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.387 177.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -110.91 108.27 18.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.091 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 54.3 mt -112.74 119.74 61.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.203 -177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . 0.485 ' CD2' HG11 ' A' ' 11' ' ' VAL . 75.7 m-85 -128.71 117.01 20.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.87 -178.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.508 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 17.4 t-80 -98.55 113.83 26.01 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.905 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.53 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.8 mp -91.11 126.07 43.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 75.1 mtm180 -80.72 -45.43 17.11 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.354 -173.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.74 -47.5 83.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -177.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.53 ' H ' HG22 ' B' ' 101' ' ' ILE . 45.2 mm-40 -81.62 -1.05 45.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' B' ' 104' ' ' GLU . 12.5 ptm180 44.12 41.79 4.44 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.166 0.916 . . . . 0.0 111.42 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -127.46 141.77 51.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.834 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.76 118.66 35.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.41 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.508 ' CE2' HD13 ' B' ' 51' ' ' LEU . 38.4 m-85 -98.62 131.48 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.36 -179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.517 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.6 mm -119.74 123.01 70.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.068 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -123.53 130.39 52.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 176.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.431 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.915 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.856 0 N-CA-C 112.059 -0.416 . . . . 0.0 112.059 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.77 -1.56 10.96 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.248 2.632 . . . . 0.0 113.146 -175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -122.21 30.36 6.61 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.067 0.46 . . . . 0.0 110.179 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 75.2 mtp -111.38 177.05 4.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.201 -179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.9 p -140.79 131.68 25.98 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.628 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.0 m -128.32 152.24 36.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.552 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -93.05 136.88 32.91 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.4 mm -106.5 124.11 36.7 Favored Pre-proline 0 C--N 1.319 -0.745 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.186 -178.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.3 136.87 32.6 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.403 2.069 . . . . 0.0 112.067 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.3 134.11 58.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.267 0.556 . . . . 0.0 110.744 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.53 HG11 ' CD2' ' B' ' 99' ' ' PHE . 4.1 p -89.09 149.12 4.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.664 -179.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 47.5 mt-10 -107.59 94.92 5.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 169.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 9.0 m -117.28 -176.11 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.586 -178.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -104.07 -29.68 10.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 176.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -151.93 166.46 31.42 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.01 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -84.04 151.33 60.21 Favored Pre-proline 0 N--CA 1.444 -0.736 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.879 177.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -53.69 167.57 0.97 Allowed 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 123.523 2.816 . . . . 0.0 113.588 175.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -63.21 130.14 43.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.639 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.6 -9.75 38.16 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.797 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.1 164.1 13.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 111.561 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -103.57 153.83 20.16 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.373 175.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 ttp85 -145.22 138.82 26.75 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 171.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 C--O 1.252 1.194 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.693 -176.175 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo . . . . . 0 N--CA 1.478 0.594 0 N-CA-C 110.306 -0.69 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -81.67 121.51 26.46 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.211 0.529 . . . . 0.0 110.186 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -138.82 -166.47 2.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.41 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -84.56 142.37 30.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.912 0.387 . . . . 0.0 110.322 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.35 153.45 19.9 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.174 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -112.14 -16.86 12.94 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.208 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . 0.411 ' HA ' ' O ' ' B' ' 58' ' ' ASN . 11.5 p-10 -100.34 -0.45 38.31 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.587 178.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 8.3 p -70.15 124.61 91.07 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.971 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -63.62 128.77 23.11 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.487 2.125 . . . . 0.0 111.685 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.461 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 31.0 tt0 -105.89 100.41 9.97 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 121.472 0.653 . . . . 0.0 109.41 178.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.403 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 90.3 m-85 -85.23 146.14 27.22 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.771 179.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.409 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 29.7 tt0 -119.16 108.5 14.74 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 176.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.502 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.4 p -96.98 137.25 25.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.48 -175.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.446 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.51 146.28 50.87 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.155 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.418 ' HG2' HD12 ' B' ' 48' ' ' LEU . 2.0 ttt -126.13 143.08 51.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.506 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 7.8 tmtm? -147.03 137.99 23.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -176.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.504 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 8.0 mpt_? -99.08 139.48 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.02 0.438 . . . . 0.0 110.725 -178.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.506 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.8 m-85 -127.02 157.07 40.56 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.222 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . 0.502 ' HZ2' ' HB2' ' B' ' 42' ' ' LYS . 0.0 OUTLIER -156.75 110.18 2.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.654 175.181 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 113.98 -1.34 24.27 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.14 171.83 7.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.567 -0.316 . . . . 0.0 110.328 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.86 -18.48 64.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.201 0.524 . . . . 0.0 110.779 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.57 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -126.39 143.04 51.31 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.805 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.524 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.54 -17.48 15.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.164 0.507 . . . . 0.0 109.832 -176.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.522 HD11 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -141.21 132.74 26.97 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.157 179.306 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.629 ' HG3' ' CE1' ' B' ' 110' ' ' TYR . 19.3 ttp180 -115.65 129.27 56.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.794 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.522 ' CD1' HD11 ' B' ' 48' ' ' LEU . 2.3 mp -125.82 127.13 71.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 176.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 0.9 OUTLIER -115.32 119.55 36.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.195 -177.032 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.16 104.21 14.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.403 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -107.78 152.22 24.66 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . 0.403 ' OD1' ' HB3' ' B' ' 59' ' ' SER . 1.7 t-20 -103.83 116.12 31.71 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.898 0.38 . . . . 0.0 110.661 -178.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -137.72 93.27 2.77 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.694 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.487 ' HB1' ' HD2' ' B' ' 57' ' ' PRO . . . -136.36 163.99 46.06 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.253 176.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.487 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 16.2 Cg_endo -57.24 -46.43 28.32 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.25 1.967 . . . . 0.0 111.909 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . 0.411 ' O ' ' HA ' ' B' ' 30' ' ' ASP . 29.3 m-80 -135.94 61.63 1.64 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.305 -176.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.479 ' OG ' ' HB2' ' B' ' 56' ' ' ALA . 13.4 m -62.21 120.96 11.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.429 -177.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 45.6 mtmt -125.51 72.92 67.87 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.013 174.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -76.5 139.61 20.69 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.107 1.872 . . . . 0.0 111.246 172.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . 0.449 ' HB3' ' HE ' ' B' ' 63' ' ' ARG . 6.7 m-20 -84.5 -66.78 0.86 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.429 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.449 ' HE ' ' HB3' ' B' ' 62' ' ' ASP . 0.8 OUTLIER -160.75 166.82 28.04 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.996 -178.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -111.6 127.88 55.87 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.44 -178.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.3 p -135.12 79.54 50.04 Favored Pre-proline 0 C--N 1.317 -0.808 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.485 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.9 Cg_endo -79.44 145.83 18.97 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.379 2.052 . . . . 0.0 112.338 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.412 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 14.2 m -153.42 147.74 25.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.45 -177.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.459 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.5 t80 -113.01 127.64 56.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.081 0.467 . . . . 0.0 111.043 -176.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.458 HD22 ' HB ' ' B' ' 74' ' ' ILE . 2.2 p-10 -105.33 116.46 31.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.172 174.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -65.9 -32.89 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.608 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.32 -53.3 55.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.535 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -105.74 7.96 32.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.713 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.72 42.37 19.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.128 0.971 . . . . 0.0 111.752 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.6 mt -116.04 137.89 48.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.489 -178.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -108.14 107.02 17.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.485 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -94.07 136.36 34.44 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.211 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 34.5 mm -90.98 -47.93 14.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.107 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.423 ' C ' ' H ' ' B' ' 80' ' ' LYS . 8.3 t-20 -159.2 175.61 13.23 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 -173.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.24 9.65 12.73 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.296 174.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' B' ' 78' ' ' ASN . 67.5 mmtt -99.54 -37.69 9.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.449 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.7 OUTLIER -162.47 153.69 17.77 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.492 0.663 . . . . 0.0 112.003 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.9 t -129.42 147.89 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.909 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mm -111.39 106.67 57.12 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.999 0.428 . . . . 0.0 110.966 -175.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.42 ' HA ' HG12 ' B' ' 74' ' ' ILE . 59.0 Cg_endo -74.94 134.36 17.82 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.155 1.903 . . . . 0.0 111.67 177.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 74.6 mt -102.37 154.95 37.07 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.684 -175.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . 0.403 ' HG2' HD13 ' B' ' 89' ' ' ILE . 40.1 Cg_endo -68.95 141.88 49.88 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.229 1.953 . . . . 0.0 111.865 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.92 -3.14 46.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.486 -176.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.62 -9.36 56.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.287 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.403 HD13 ' HG2' ' B' ' 86' ' ' PRO . 61.2 mt -114.04 134.19 57.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.478 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.25 111.66 22.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 58.6 t -116.05 133.7 61.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.145 0.498 . . . . 0.0 111.038 -173.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.455 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.36 160.75 39.47 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.405 177.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.97 -20.62 64.04 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.173 0.511 . . . . 0.0 111.588 -176.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -12.99 56.66 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.249 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.455 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.9 t70 -110.07 -24.31 10.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.493 0.663 . . . . 0.0 109.812 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 86.7 mt -69.69 118.35 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.168 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -112.98 107.38 15.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.9 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 56.8 mt -110.28 121.76 63.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 111.428 -178.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . 0.53 ' CD2' HG11 ' A' ' 11' ' ' VAL . 78.8 m-85 -129.12 118.84 23.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.199 -179.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.509 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 23.8 t-80 -104.44 108.64 20.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.136 0.493 . . . . 0.0 110.41 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.563 HG22 ' H ' ' B' ' 104' ' ' GLU . 66.2 mt -86.73 98.61 7.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.439 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . 0.415 ' HD2' ' OE2' ' A' ' 12' ' ' GLU . 14.2 ptm180 -74.8 -10.96 60.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.508 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.39 -43.15 74.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.386 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.563 ' H ' HG22 ' B' ' 101' ' ' ILE . 30.0 mm-40 -99.9 -6.86 26.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.454 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 61.35 36.96 17.3 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.502 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 19.4 m -123.26 142.26 51.11 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.373 -176.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.15 121.59 44.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.161 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.476 ' CE1' HD12 ' B' ' 101' ' ' ILE . 17.7 m-85 -106.17 130.19 54.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.163 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.511 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.4 mm -118.11 124.43 73.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.629 ' CE1' ' HG3' ' B' ' 49' ' ' ARG . 98.9 m-85 -128.62 125.02 37.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.908 0.385 . . . . 0.0 110.288 177.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.57 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 56.2 mt . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.648 -0.692 . . . . 0.0 109.718 -179.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.886 0 N-CA-C 112.005 -0.438 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.86 -58.98 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.857 2.371 . . . . 0.0 112.222 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -72.94 146.4 46.1 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -71.57 167.32 19.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.517 0.675 . . . . 0.0 112.249 -172.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.8 p -136.45 128.47 29.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.036 174.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.409 ' CG2' ' HB3' ' B' ' 93' ' ' ALA . 15.6 m -121.38 138.79 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.047 0.451 . . . . 0.0 111.659 -173.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.23 138.27 32.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.843 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.45 ' HB ' HD13 ' B' ' 98' ' ' ILE . 4.9 mm -110.06 117.44 51.81 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -177.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.75 128.28 17.68 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.427 2.085 . . . . 0.0 112.38 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 43.5 t -91.78 131.38 39.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.665 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.472 HG13 ' HA ' ' B' ' 99' ' ' PHE . 2.3 p -87.08 147.57 5.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.0 mt-10 -115.29 93.98 4.53 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 119.705 -0.798 . . . . 0.0 109.682 168.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.9 m -110.92 -179.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.637 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -86.25 -32.63 21.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.519 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.7 pt-20 -170.48 172.05 6.19 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.678 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.7 144.08 72.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-O 120.542 0.21 . . . . 0.0 110.45 -179.355 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -68.08 172.53 10.78 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.278 1.986 . . . . 0.0 111.955 178.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -57.05 133.64 55.14 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.488 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.25 -11.31 31.25 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.245 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -97.58 159.49 14.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 0.0 111.472 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -114.81 95.23 5.12 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.792 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 -87.44 148.34 25.02 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.061 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 C--O 1.247 0.935 0 O-C-N 123.663 0.602 . . . . 0.0 111.387 -179.695 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo . . . . . 0 N--CA 1.475 0.439 0 N-CA-C 110.623 -0.568 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -140.42 84.98 1.98 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.876 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -86.75 -156.47 0.32 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.48 ' NE2' ' H ' ' B' ' 27' ' ' GLN . 0.0 OUTLIER -60.21 141.73 55.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.981 0.419 . . . . 0.0 110.023 174.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -99.6 157.43 16.46 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.833 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -101.94 -18.84 15.5 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.655 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -92.32 31.03 1.36 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.146 0.498 . . . . 0.0 110.269 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.4 t -90.5 111.11 45.64 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.807 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.83 129.29 17.27 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 121.837 1.691 . . . . 0.0 111.063 175.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.481 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 34.2 tt0 -102.69 102.57 12.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.417 0.627 . . . . 0.0 109.648 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.45 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.2 m-85 -86.89 138.58 31.43 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.487 175.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.428 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 22.8 tt0 -118.75 110.04 16.79 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.508 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.1 p -97.53 131.71 43.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.358 -174.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.428 ' HE2' ' HG2' ' B' ' 35' ' ' GLU . 0.1 OUTLIER -124.0 132.34 53.69 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.509 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.497 ' HG2' HD13 ' B' ' 48' ' ' LEU . 2.1 ttt -113.79 143.24 44.98 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.782 -176.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.512 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 7.0 tmtm? -149.47 135.49 18.88 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.12 -0.232 . . . . 0.0 110.473 -176.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.512 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER -92.28 128.98 38.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.009 0.433 . . . . 0.0 111.017 178.419 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.47 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 11.3 m-85 -114.56 138.98 49.97 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.805 176.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -138.55 106.61 5.72 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.164 0.506 . . . . 0.0 109.719 176.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 122.19 2.84 9.93 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.741 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -114.6 171.63 7.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.76 -21.06 65.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.341 0.591 . . . . 0.0 110.551 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.648 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.8 p90 -119.28 141.65 48.78 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.789 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.507 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.6 mppt? -105.42 -15.39 15.03 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.454 0.645 . . . . 0.0 109.81 -175.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.553 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.11 130.42 28.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.889 177.503 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 17.8 ttp180 -119.47 123.5 44.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.892 177.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.553 ' CD1' HD12 ' B' ' 48' ' ' LEU . 1.9 mp -120.54 127.21 75.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.5 mm? -110.1 112.27 24.15 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.046 -178.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -120.02 103.88 14.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.6 pt-20 -109.58 153.3 24.36 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.633 -178.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -95.56 108.12 20.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.723 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -135.39 92.37 2.84 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.41 0.624 . . . . 0.0 110.255 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.487 ' HB2' ' HB2' ' B' ' 59' ' ' SER . . . -136.49 156.27 76.52 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.938 176.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -66.12 -32.81 42.49 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.432 2.088 . . . . 0.0 112.676 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -142.48 62.14 1.42 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.22 0.533 . . . . 0.0 110.241 -176.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.487 ' HB2' ' HB2' ' B' ' 56' ' ' ALA . 8.5 t -79.77 151.41 30.37 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.037 -171.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -136.61 83.59 29.96 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.62 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -64.34 147.47 90.85 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 122.63 2.22 . . . . 0.0 111.757 175.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -116.03 -73.65 0.64 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.489 -177.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -161.04 170.42 20.54 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -125.0 119.43 28.68 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.939 0.4 . . . . 0.0 111.021 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 41.5 m -138.67 80.3 26.31 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.863 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.466 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 90.1 Cg_endo -82.92 162.23 15.93 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.87 2.38 . . . . 0.0 112.213 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.5 p -162.71 136.49 6.16 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.545 ' HH ' HG12 ' B' ' 91' ' ' VAL . 52.0 t80 -98.23 115.76 29.04 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.492 -179.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.49 114.71 26.39 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.706 176.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -63.66 -25.05 68.04 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.428 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.86 71.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.845 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.478 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.56 3.91 17.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.358 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . 0.542 HD22 ' NE ' ' B' ' 87' ' ' ARG . 2.5 p-10 47.54 45.33 17.51 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.472 1.107 . . . . 0.0 111.469 -174.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.478 HG13 ' O ' ' B' ' 72' ' ' GLU . 64.6 mt -123.17 137.11 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.01 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -107.17 103.72 13.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.43 141.49 28.69 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . 0.466 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 33.7 mm -95.27 -48.36 12.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.628 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.495 ' C ' ' H ' ' B' ' 80' ' ' LYS . 9.1 t-20 -155.97 171.94 19.23 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.076 -171.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.15 38.65 1.15 Allowed Glycine 0 C--O 1.228 -0.228 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 176.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . 0.495 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.2 mmtt -130.45 -41.1 1.23 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.46 HD13 ' O ' ' B' ' 81' ' ' LEU . 0.5 OUTLIER -157.95 153.97 27.04 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.205 -175.487 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 49.1 p -125.61 145.42 50.15 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.226 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.0 mm -111.55 100.43 47.89 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.7 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -71.4 142.82 41.74 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.77 2.313 . . . . 0.0 112.036 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.21 142.54 25.08 Favored Pre-proline 0 C--N 1.318 -0.783 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.016 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . 0.414 ' HG2' HD11 ' B' ' 89' ' ' ILE . 24.9 Cg_endo -63.45 139.24 69.72 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.242 1.962 . . . . 0.0 111.281 176.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.542 ' NE ' HD22 ' B' ' 73' ' ' ASN . 8.7 mpt_? -74.31 -3.18 28.68 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.259 -174.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -80.58 -19.35 45.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.524 0.678 . . . . 0.0 109.566 178.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.414 HD11 ' HG2' ' B' ' 86' ' ' PRO . 59.6 mt -104.1 131.48 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.61 -176.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.0 t -84.57 110.23 18.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . 0.545 HG12 ' HH ' ' B' ' 68' ' ' TYR . 1.7 p -120.74 132.44 70.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 121.468 0.652 . . . . 0.0 111.41 -172.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.523 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.81 164.6 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.194 179.144 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . 0.409 ' HB3' ' CG2' ' A' ' 6' ' ' VAL . . . -61.51 -21.28 64.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.692 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.94 -15.81 52.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.042 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.523 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 19.1 t0 -106.81 -21.91 12.88 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.65 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.7 mt -74.79 119.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.267 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.475 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.4 mmmt -113.64 106.42 14.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.065 179.045 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.45 HD13 ' HB ' ' A' ' 8' ' ' ILE . 49.8 mt -109.99 121.75 63.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.174 0.511 . . . . 0.0 111.177 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . 0.475 ' CE1' ' HB3' ' B' ' 97' ' ' LYS . 53.9 m-85 -130.94 124.32 30.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.132 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.563 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 26.9 t-80 -106.38 117.03 32.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.039 0.447 . . . . 0.0 110.578 177.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.535 HD11 ' CE1' ' B' ' 108' ' ' TYR . 69.0 mt -99.58 104.84 16.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 172.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.49 -21.58 48.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.403 -174.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -68.81 -43.68 75.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.016 0.436 . . . . 0.0 110.496 176.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.53 ' H ' HG23 ' B' ' 101' ' ' ILE . 11.1 mm-40 -87.73 -7.17 57.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.284 0.564 . . . . 0.0 110.088 177.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 57.06 35.87 26.93 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.51 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 33.2 m -124.43 138.49 54.35 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.623 -174.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.76 123.05 48.85 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.535 ' CE1' HD11 ' B' ' 101' ' ' ILE . 19.4 m-85 -105.73 129.59 53.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.854 -176.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.522 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.2 mm -117.37 119.62 62.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.858 177.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.45 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.7 m-85 -122.49 122.7 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 176.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.648 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 68.0 mt . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.902 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.712 0 N-CA-C 112.006 -0.438 . . . . 0.0 112.006 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.75 -10.09 27.06 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.91 2.407 . . . . 0.0 112.848 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -135.53 29.43 3.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.829 0.347 . . . . 0.0 110.45 177.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 42.9 tpp -108.76 133.36 52.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.889 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.421 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 4.2 m -145.45 137.6 25.62 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.992 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.5 m -123.52 150.0 27.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.027 0.441 . . . . 0.0 110.721 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.501 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -91.4 139.66 30.51 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.762 179.099 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.433 ' HB ' HD11 ' B' ' 98' ' ' ILE . 6.0 mm -110.42 119.54 46.48 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.137 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.47 128.44 17.24 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.099 1.866 . . . . 0.0 112.207 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.418 HG22 HG21 ' B' ' 98' ' ' ILE . 2.6 p -105.21 135.48 43.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.811 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.536 HG22 ' HA ' ' B' ' 99' ' ' PHE . 0.9 OUTLIER -86.59 150.04 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.044 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.613 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 35.2 mt-10 -116.58 94.77 4.75 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.862 168.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.436 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 16.6 m -114.86 -171.3 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.508 -177.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -103.4 -23.15 13.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.797 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.421 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.6 pt-20 -170.27 161.68 8.33 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.204 176.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.6 150.03 69.18 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.504 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -72.96 174.17 12.39 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.805 2.337 . . . . 0.0 112.142 176.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -59.66 146.09 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.983 0.421 . . . . 0.0 110.503 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.6 -16.36 54.92 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 111.211 -0.755 . . . . 0.0 111.211 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.33 153.41 18.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -110.51 100.88 9.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.114 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -100.34 144.75 28.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.124 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.928 -0.558 . . . . 0.0 110.551 -176.146 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.478 0.61 0 N-CA-C 110.759 -0.516 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 70.07 -60.89 0.47 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.379 0.672 . . . . 0.0 111.42 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -99.74 134.24 42.93 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 177.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -87.55 156.93 19.29 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.586 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -127.69 156.65 42.04 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.46 0.648 . . . . 0.0 111.212 -177.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -154.37 -9.91 0.14 Allowed 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.91 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -78.35 -2.81 39.97 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.549 175.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.9 t -55.97 120.11 31.36 Favored Pre-proline 0 N--CA 1.444 -0.741 0 CA-C-N 114.296 -1.32 . . . . 0.0 110.344 177.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -66.18 128.95 20.53 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.261 1.974 . . . . 0.0 111.738 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.422 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 23.2 tt0 -104.68 101.37 11.01 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 121.533 0.682 . . . . 0.0 109.733 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 94.3 m-85 -85.07 157.05 20.82 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.767 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.442 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 37.7 tt0 -126.34 112.11 15.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.252 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 59.3 t -93.55 128.61 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 O-C-N 123.469 0.481 . . . . 0.0 111.183 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.442 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -129.86 119.53 23.47 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.43 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.506 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -104.35 140.56 37.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.431 -175.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.445 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 2.2 tmtp? -149.26 138.08 21.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 110.696 -174.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.468 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 8.6 mpt_? -98.75 135.84 39.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.201 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.445 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 26.6 m-85 -115.14 143.51 45.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.188 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -127.56 101.92 6.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.336 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.55 32.04 6.17 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.541 -0.837 . . . . 0.0 112.519 178.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.19 172.1 10.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.84 -27.26 63.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.447 0.641 . . . . 0.0 110.531 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.629 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.3 p90 -120.59 143.87 48.41 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.748 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.51 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.7 mppt? -101.82 -22.35 14.38 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.418 -176.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.508 HD13 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.94 132.92 31.12 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.815 -178.423 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -119.75 129.57 54.56 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.508 ' CD1' HD13 ' B' ' 48' ' ' LEU . 2.3 mp -124.7 127.96 73.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.485 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.1 mm? -111.04 121.54 45.62 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . 0.408 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 4.5 mp -126.18 102.67 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 177.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.8 pt-20 -112.34 154.34 25.87 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.12 0.486 . . . . 0.0 110.628 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -99.1 111.35 23.76 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.535 -176.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . 0.466 ' O ' ' HD3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.79 92.57 2.91 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.504 0.669 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.452 ' HB1' ' HD2' ' B' ' 57' ' ' PRO . . . -131.88 162.62 55.37 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.287 176.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.485 ' HB2' ' ND2' ' B' ' 58' ' ' ASN . 11.2 Cg_endo -53.59 -45.28 42.2 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.788 2.326 . . . . 0.0 111.798 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . 0.485 ' ND2' ' HB2' ' B' ' 57' ' ' PRO . 0.6 OUTLIER -146.82 73.63 1.32 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.35 179.556 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.45 ' OG ' ' HB2' ' B' ' 56' ' ' ALA . 2.4 m -67.13 128.07 35.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.777 -174.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -132.87 73.62 75.48 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.378 174.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.2 162.69 41.71 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.72 2.28 . . . . 0.0 112.842 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -86.27 -76.05 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.243 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -159.87 -175.59 5.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.274 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -127.7 114.23 17.05 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.445 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -138.8 79.81 26.97 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-O 121.231 0.539 . . . . 0.0 109.745 175.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.458 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 66.8 Cg_endo -77.1 150.81 29.88 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.735 2.29 . . . . 0.0 112.345 -178.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.407 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 17.0 m -153.57 143.63 22.12 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.338 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -104.54 113.4 26.94 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.296 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . 0.468 HD22 ' HB ' ' B' ' 74' ' ' ILE . 0.8 OUTLIER -95.57 108.26 20.5 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.502 177.128 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -60.03 -28.35 67.68 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.19 -44.37 64.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.248 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.513 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.4 mt-10 -114.15 3.38 15.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.996 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 47.8 43.74 17.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.068 0.947 . . . . 0.0 111.453 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.513 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.0 mt -121.93 138.09 53.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.142 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.401 HD11 ' C ' ' B' ' 75' ' ' LEU . 3.5 tm? -100.42 101.68 12.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -89.19 139.48 30.44 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.511 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.8 mm -91.73 -53.23 9.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.499 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.4 p30 -162.48 -165.99 1.28 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.866 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.63 0.59 69.91 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.686 178.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -92.22 -42.4 9.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.413 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -158.63 153.74 25.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.935 -178.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 31.3 t -133.53 150.2 51.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.325 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.4 mm -114.79 105.73 52.88 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.999 0.428 . . . . 0.0 110.95 -174.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.29 136.06 11.12 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.422 2.082 . . . . 0.0 112.599 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.73 146.67 32.25 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.102 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . 0.481 ' HB2' ' OD1' ' B' ' 88' ' ' ASP . 23.3 Cg_endo -62.49 141.7 87.59 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.459 2.106 . . . . 0.0 111.654 176.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -73.88 -7.06 50.85 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.55 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . 0.481 ' OD1' ' HB2' ' B' ' 86' ' ' PRO . 4.6 p-10 -89.29 -4.19 58.23 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.876 0.37 . . . . 0.0 110.781 -178.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.446 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.7 mt -112.29 135.55 51.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.318 179.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -87.21 116.34 29.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.299 0.571 . . . . 0.0 110.19 177.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 54.1 t -121.91 133.56 67.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.293 0.568 . . . . 0.0 111.184 -174.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.447 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.27 159.3 42.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.566 177.915 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.12 -16.67 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.875 -175.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.73 -14.14 49.21 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.025 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.447 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 27.4 t70 -109.31 -22.35 12.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.353 0.597 . . . . 0.0 109.978 -177.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . 0.417 HG23 HG13 ' B' ' 98' ' ' ILE . 85.6 mt -71.4 117.42 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.619 176.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.442 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 26.0 mmmt -112.28 104.7 12.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.677 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . 0.433 HD11 ' HB ' ' A' ' 8' ' ' ILE . 53.5 mt -108.87 117.89 55.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.198 0.523 . . . . 0.0 111.48 -177.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . 0.536 ' HA ' HG22 ' A' ' 11' ' ' VAL . 96.1 m-85 -127.78 121.96 31.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.451 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 t-80 -104.93 123.13 47.22 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 110.173 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.548 HG22 ' H ' ' B' ' 104' ' ' GLU . 52.4 mt -99.05 120.65 48.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.154 0.502 . . . . 0.0 109.846 175.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' B' ' 102' ' ' ARG . 3.9 ptt180 -75.77 -35.91 59.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.756 -176.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.28 -41.27 66.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.101 0.477 . . . . 0.0 110.53 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.548 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.3 tp10 -81.09 -10.9 59.6 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.397 -178.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 30.5 mmm180 58.57 29.49 18.52 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.11 -178.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.412 HG23 ' HB3' ' B' ' 53' ' ' GLU . 85.4 m -127.08 139.77 52.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.59 -168.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.49 120.64 43.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.521 177.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.485 ' CE2' HD11 ' B' ' 51' ' ' LEU . 23.7 m-85 -101.33 125.29 47.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.714 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.451 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.8 mm -113.64 116.39 52.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.114 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.442 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 80.2 m-85 -117.36 124.55 49.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 175.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.629 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.0 mt . . . . . 0 C--O 1.245 0.834 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.592 178.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 112.077 -0.409 . . . . 0.0 112.077 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.482 ' O ' ' HA ' ' B' ' 71' ' ' ALA . 57.7 Cg_endo -71.68 105.82 1.85 Allowed 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.52 2.147 . . . . 0.0 112.566 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.6 p-80 -144.27 21.8 1.71 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 0.0 110.563 178.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -123.46 162.31 23.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.58 -177.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.7 p -132.77 144.55 50.33 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.6 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -130.42 142.15 44.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.345 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.93 137.72 32.13 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.684 0.278 . . . . 0.0 110.251 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.5 mm -110.32 120.57 43.87 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -76.81 135.35 15.77 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.243 1.962 . . . . 0.0 112.068 177.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.1 t -85.06 132.93 30.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.605 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.42 HG12 HG11 ' A' ' 13' ' ' VAL . 82.0 t -95.93 112.21 27.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 172.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.499 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 40.7 mt-10 -91.42 110.15 21.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.453 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.42 HG11 HG12 ' A' ' 11' ' ' VAL . 2.5 m -130.31 -176.18 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.662 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -84.09 -30.04 26.3 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -172.78 -178.65 1.92 Allowed 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.158 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.437 HD21 ' HB2' ' A' ' 22' ' ' ARG . 2.4 mm? -77.46 150.83 80.09 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-O 120.808 0.337 . . . . 0.0 110.129 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -65.39 172.63 7.48 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.544 2.163 . . . . 0.0 111.535 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.94 139.67 56.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.354 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.21 -15.38 50.86 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.94 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -84.64 173.29 10.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.762 0.315 . . . . 0.0 110.459 176.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -126.89 100.07 6.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.989 0.423 . . . . 0.0 110.826 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.437 ' HB2' HD21 ' A' ' 16' ' ' LEU . 56.7 ttp85 -109.9 147.42 33.43 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.286 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.7 m . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.007 179.154 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo . . . . . 0 N--CA 1.481 0.788 0 N-CA-C 111.304 -0.306 . . . . 0.0 111.304 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 43.1 t-80 -80.63 113.3 18.73 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . 0.505 ' HG3' ' H ' ' B' ' 27' ' ' GLN . 4.1 tp10 67.83 -154.01 0.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.303 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.505 ' H ' ' HG3' ' B' ' 26' ' ' GLU . 2.2 mp0 -92.35 -174.44 3.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.976 0.417 . . . . 0.0 110.491 -177.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -82.52 -168.69 2.11 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.389 0.614 . . . . 0.0 111.605 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.15 -10.39 17.99 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.239 -0.892 . . . . 0.0 111.384 -175.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -84.49 -7.38 59.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.596 -178.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 50.8 t -60.5 111.8 4.6 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.142 -172.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.618 ' HA ' ' OG ' ' B' ' 59' ' ' SER . 76.3 Cg_endo -80.47 130.23 7.85 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.739 2.292 . . . . 0.0 111.706 175.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -92.92 97.08 10.51 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.348 0.594 . . . . 0.0 109.527 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.465 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.0 m-85 -83.35 144.05 29.93 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.13 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -120.54 114.43 21.74 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.486 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 60.4 t -96.96 129.43 47.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.47 -174.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -123.0 136.37 54.83 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.744 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.515 ' HG2' HD12 ' B' ' 48' ' ' LEU . 0.7 OUTLIER -117.1 127.34 54.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.95 0.405 . . . . 0.0 110.922 -179.274 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.577 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 7.3 tmtm? -125.42 118.48 25.96 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -175.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.407 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 6.6 mpt_? -90.09 127.12 36.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.257 0.551 . . . . 0.0 111.52 -172.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.577 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 25.5 m-85 -109.28 167.74 9.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.86 176.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.92 127.17 9.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.465 174.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 74.56 33.75 55.35 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.472 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.17 172.18 10.77 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.768 -0.254 . . . . 0.0 110.401 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.52 -22.96 65.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.293 0.568 . . . . 0.0 110.5 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.618 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -130.83 142.06 50.37 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.958 178.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.517 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.99 -19.21 18.16 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.059 0.457 . . . . 0.0 109.83 -176.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.57 HD13 ' O ' ' B' ' 39' ' ' LYS . 0.0 OUTLIER -143.22 134.74 26.3 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.234 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.438 ' H ' HD13 ' B' ' 48' ' ' LEU . 34.4 ttp180 -113.73 113.0 24.37 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 171.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.1 mp -108.34 127.86 64.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.534 HD12 ' CE2' ' B' ' 108' ' ' TYR . 2.8 mm? -110.12 117.96 35.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.282 -177.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.93 103.71 13.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 16.5 pt-20 -113.23 153.79 27.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.968 0.413 . . . . 0.0 110.543 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . 0.427 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -96.85 112.67 24.32 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.899 -177.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -138.43 91.32 2.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.027 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.705 ' HB3' ' OG ' ' B' ' 59' ' ' SER . . . -137.68 162.59 53.77 Favored Pre-proline 0 C--N 1.321 -0.659 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.947 172.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.413 ' HD2' ' HB2' ' B' ' 56' ' ' ALA . 25.9 Cg_endo -59.57 -40.62 64.16 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.661 2.241 . . . . 0.0 111.079 172.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -136.67 93.99 2.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.403 -177.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.705 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 58.8 m -119.45 132.54 55.82 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.094 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -132.88 72.97 76.44 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.881 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.0 147.27 23.78 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.693 2.262 . . . . 0.0 112.431 177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . 0.502 ' HB3' ' HE ' ' B' ' 63' ' ' ARG . 9.5 m-20 -103.37 -68.31 0.84 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.452 179.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.502 ' HE ' ' HB3' ' B' ' 62' ' ' ASP . 0.4 OUTLIER -160.11 170.05 22.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.905 -0.588 . . . . 0.0 109.904 -179.217 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -116.11 147.21 41.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.665 0.745 . . . . 0.0 110.794 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 19.4 t -142.23 78.96 16.36 Favored Pre-proline 0 C--N 1.305 -1.337 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.803 172.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.481 ' C ' ' HG ' ' B' ' 67' ' ' SER . 71.9 Cg_endo -78.65 156.64 28.05 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.937 2.425 . . . . 0.0 112.402 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.481 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 20.3 m -158.51 144.88 17.18 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.229 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.426 ' HB2' HD22 ' B' ' 75' ' ' LEU . 55.7 t80 -106.39 119.04 38.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.583 -177.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -100.02 113.47 26.08 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.37 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -62.71 -32.09 73.13 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.631 -177.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 2' ' ' PRO . . . -52.62 -50.12 63.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.666 -178.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.533 ' O ' HG13 ' B' ' 74' ' ' ILE . 3.0 mm-40 -103.6 1.6 32.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.391 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 46.97 46.07 15.67 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 124.375 1.047 . . . . 0.0 111.537 -175.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.533 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.7 mt -124.0 138.41 53.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.191 -178.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.426 HD22 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -104.82 102.26 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -88.75 138.6 31.27 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.59 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . 0.407 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 34.9 mm -92.3 -46.53 14.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.084 -175.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -150.26 -179.94 7.61 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.65 1.94 60.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.585 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -101.35 -33.97 9.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.626 -0.287 . . . . 0.0 111.146 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.435 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -154.4 153.32 31.39 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.309 0.576 . . . . 0.0 112.226 178.543 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 33.1 p -129.73 151.78 49.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.178 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mm -111.9 105.01 56.51 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 120.849 0.357 . . . . 0.0 110.514 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -80.34 135.78 10.91 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.632 2.221 . . . . 0.0 112.713 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -103.14 148.26 35.37 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.17 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -66.63 137.73 47.07 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.18 1.92 . . . . 0.0 111.389 175.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.405 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 0.0 OUTLIER -70.5 -3.99 20.62 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.739 -175.832 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.62 -11.58 58.29 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.465 0.65 . . . . 0.0 109.972 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 54.6 mt -107.59 132.04 56.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.534 -179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 57.8 t -82.91 110.59 18.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 175.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 49.1 t -115.34 132.77 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.67 -174.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.586 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.27 162.2 36.04 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.617 177.481 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.63 -17.82 63.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.89 -175.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.26 -16.41 40.25 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.794 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.586 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 21.0 t0 -104.57 -23.07 13.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.547 0.689 . . . . 0.0 109.672 -176.04 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.44 114.6 13.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.969 177.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.412 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 24.1 mmmt -108.56 105.96 15.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.808 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 48.9 mt -109.38 116.18 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.373 . . . . 0.0 110.856 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . 0.419 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.7 m-85 -129.39 119.83 24.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -177.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.499 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.8 t-80 -102.62 114.2 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.527 HD11 ' CD1' ' B' ' 108' ' ' TYR . 4.2 mp -95.87 101.14 12.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 171.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -78.5 -15.8 58.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.471 -174.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.44 -41.64 80.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.877 0.37 . . . . 0.0 110.152 175.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.473 ' H ' HG21 ' B' ' 101' ' ' ILE . 13.6 mm-40 -94.32 -3.67 50.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.493 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 59.15 35.78 23.79 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.404 -177.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 27.6 m -125.63 134.75 51.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.982 0.42 . . . . 0.0 110.866 -173.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 49.3 tp -108.63 117.49 34.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.232 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.534 ' CE2' HD12 ' B' ' 51' ' ' LEU . 35.7 m-85 -97.78 129.1 44.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.081 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 42.2 mm -116.06 123.1 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.961 176.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.412 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 83.7 m-85 -121.34 127.54 51.38 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.618 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 65.3 mt . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.594 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.744 0 N-CA-C 111.761 -0.536 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.57 -25.12 77.79 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 123.031 2.487 . . . . 0.0 113.208 -179.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -147.14 -72.28 0.22 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.67 0.271 . . . . 0.0 110.73 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 56.6 ttm -172.68 150.39 2.17 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -176.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.3 p -152.43 132.54 13.49 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.61 0.243 . . . . 0.0 110.423 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.403 ' CG2' ' HB1' ' B' ' 93' ' ' ALA . 15.2 m -127.45 144.37 37.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.676 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -84.98 138.68 32.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' B' ' 67' ' ' SER . 7.7 mm -107.56 119.85 49.26 Favored Pre-proline 0 C--N 1.321 -0.656 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.119 178.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.38 135.62 24.86 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.557 2.171 . . . . 0.0 112.575 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -93.54 124.23 45.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.566 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.428 ' HB ' ' CD2' ' B' ' 99' ' ' PHE . 58.7 t -92.55 118.47 38.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.421 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.8 mt-10 -94.0 111.02 22.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.379 0.609 . . . . 0.0 110.269 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 m -127.74 -175.81 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.107 -177.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.415 ' O ' HG21 ' B' ' 101' ' ' ILE . 27.1 t70 -85.97 -29.75 23.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.506 ' HA ' ' CG1' ' B' ' 101' ' ' ILE . 13.0 pt-20 -178.28 175.26 1.21 Allowed 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.077 173.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.8 mm? -71.88 153.62 92.96 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.788 0.327 . . . . 0.0 111.119 -174.001 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.81 173.04 15.1 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.193 1.929 . . . . 0.0 111.446 174.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.25 138.76 57.87 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.619 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.61 -10.46 41.89 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.831 -175.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -103.92 152.65 21.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.992 0.425 . . . . 0.0 111.598 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -112.91 104.0 11.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.327 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.621 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 63.7 ttp85 -105.52 149.21 26.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.159 -176.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.611 -0.709 . . . . 0.0 109.941 175.559 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo . . . . . 0 N--CA 1.48 0.733 0 N-CA-C 111.251 -0.327 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -139.69 45.44 1.92 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.441 0.638 . . . . 0.0 110.688 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -86.87 -163.55 0.93 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.035 177.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -87.81 142.68 27.62 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . 0.47 ' HG3' HG21 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -107.71 163.34 13.18 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.447 -177.774 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -148.64 -19.94 0.32 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.143 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -82.11 -7.52 59.62 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.888 0.375 . . . . 0.0 110.892 -176.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.47 HG21 ' HG3' ' B' ' 28' ' ' GLN . 58.6 t -56.25 120.34 34.32 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.467 -177.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.471 ' HA ' ' CB ' ' B' ' 59' ' ' SER . 43.2 Cg_endo -71.68 129.51 15.7 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.419 2.079 . . . . 0.0 112.452 177.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -102.09 100.6 10.86 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.476 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.4 m-85 -87.35 155.98 19.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.927 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -130.21 118.06 20.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.961 175.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -95.96 138.89 20.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.822 -174.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.477 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -132.52 151.75 51.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 175.312 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.49 ' HG2' HD13 ' B' ' 48' ' ' LEU . 2.1 ttt -132.77 141.7 48.64 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 8.7 tmtm? -144.88 135.76 24.74 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.636 -176.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . 0.481 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 7.6 mpt_? -98.61 129.48 45.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.995 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.453 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 31.3 m-85 -107.91 146.9 31.73 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.5 177.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . 0.461 ' HB3' ' HZ1' ' B' ' 42' ' ' LYS . 6.2 ttpm? -129.37 100.11 5.45 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.903 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 93.39 45.19 3.55 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.203 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -133.45 170.74 15.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.78 -17.04 63.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.281 0.562 . . . . 0.0 110.776 177.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.502 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -130.34 140.16 50.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . 0.548 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -95.28 -24.37 16.8 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.226 0.536 . . . . 0.0 109.668 -174.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.507 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.59 136.76 37.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.249 -177.3 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -120.72 129.58 53.7 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.515 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.6 mp -123.03 129.85 74.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.543 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.0 mm? -114.26 118.89 35.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.51 -175.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -124.36 103.53 12.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.1 pt-20 -107.22 153.65 22.38 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.579 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.23 112.46 24.61 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.646 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -136.88 92.82 2.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.37 0.605 . . . . 0.0 110.682 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.508 ' HB2' ' HB3' ' B' ' 59' ' ' SER . . . -137.89 162.29 55.12 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.178 176.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.45 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 25.7 Cg_endo -64.2 -40.36 26.4 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 121.949 1.766 . . . . 0.0 112.591 179.109 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -136.92 36.95 2.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.644 -173.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.508 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 4.6 p -76.01 132.36 40.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.876 0.37 . . . . 0.0 111.937 -177.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -135.64 76.96 53.28 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.707 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.8 139.63 44.21 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.382 2.055 . . . . 0.0 111.803 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -91.18 -44.12 9.44 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.761 -177.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -162.68 174.87 11.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.978 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -125.89 133.16 52.0 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.965 175.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.7 p -136.38 79.46 42.25 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.169 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.412 ' C ' ' HG ' ' B' ' 67' ' ' SER . 91.4 Cg_endo -87.8 153.86 7.37 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.828 2.352 . . . . 0.0 112.391 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.412 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 24.7 m -157.18 150.29 23.74 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.501 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.416 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 48.8 t80 -109.05 125.45 52.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.507 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -106.54 117.93 35.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -70.17 -14.92 62.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.828 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.13 -50.94 71.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.101 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.511 ' O ' HD13 ' B' ' 74' ' ' ILE . 6.3 mm-40 -113.36 0.1 14.68 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.307 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' B' ' 85' ' ' LEU . 1.8 p-10 51.35 48.28 23.27 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 124.712 1.257 . . . . 0.0 111.014 -171.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.527 HD11 ' HA ' ' B' ' 84' ' ' PRO . 0.3 OUTLIER -107.27 146.97 12.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.736 177.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.402 HD22 ' HB2' ' B' ' 68' ' ' TYR . 3.2 tm? -115.72 102.38 9.68 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -91.07 139.93 30.3 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -178.565 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.0 mm -93.25 -46.42 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.618 -174.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.469 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.2 t-20 -161.93 178.59 8.75 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -175.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.17 32.83 1.31 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.195 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . 0.469 ' H ' ' C ' ' B' ' 78' ' ' ASN . 28.2 mmmt -125.07 -44.66 1.9 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.509 HD13 ' O ' ' B' ' 81' ' ' LEU . 1.0 OUTLIER -152.25 153.65 34.18 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.784 -177.978 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 13.3 p -126.52 145.82 50.36 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.055 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.6 mm -107.83 111.07 62.55 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.603 -178.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.527 ' HA ' HD11 ' B' ' 74' ' ' ILE . 59.8 Cg_endo -75.69 132.8 14.88 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.992 1.795 . . . . 0.0 111.899 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 78.7 mt -102.6 148.26 35.25 Favored Pre-proline 0 C--N 1.323 -0.561 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.773 -176.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.93 142.93 43.89 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.739 2.293 . . . . 0.0 112.327 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.423 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 9.1 mpt_? -79.07 -6.48 56.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.931 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -79.52 -18.83 51.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.639 0.733 . . . . 0.0 109.714 179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 55.8 mt -107.56 131.5 57.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.773 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.2 115.83 27.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . 0.416 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -126.24 134.85 65.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.324 0.583 . . . . 0.0 111.222 -173.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . 0.426 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.79 164.91 28.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.855 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . 0.403 ' HB1' ' CG2' ' A' ' 6' ' ' VAL . . . -63.77 -16.85 62.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.867 -175.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.48 -12.41 43.08 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.177 0.513 . . . . 0.0 110.905 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . 0.426 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 25.5 t0 -109.24 -26.87 9.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.951 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.5 mt -69.79 114.98 7.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.04 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -108.45 103.42 12.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.401 179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 40.4 mt -107.14 121.51 60.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.796 179.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . 0.428 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 76.3 m-85 -134.56 121.2 20.61 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.275 -178.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.421 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 17.5 t-80 -96.34 110.75 23.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.463 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.696 HD11 ' CD1' ' B' ' 108' ' ' TYR . 3.2 mp -91.87 107.55 18.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 173.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -73.85 -23.19 59.58 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.971 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -60.64 -47.59 85.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.164 0.507 . . . . 0.0 110.643 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.627 ' H ' HG22 ' B' ' 101' ' ' ILE . 15.6 mm-40 -92.61 -3.42 55.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.641 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 57.99 34.39 24.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.128 -176.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' THR . . . . . 0.416 HG22 ' HB3' ' B' ' 53' ' ' GLU . 41.2 m -129.16 141.6 51.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.201 -170.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.8 tp -107.12 120.31 41.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.007 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.696 ' CD1' HD11 ' B' ' 101' ' ' ILE . 21.2 m-85 -102.6 130.61 49.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.014 -178.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.515 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.5 mm -115.49 120.23 64.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.9 177.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.423 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.7 m-85 -121.01 126.66 50.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.502 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.646 -0.692 . . . . 0.0 109.82 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.845 0 N-CA-C 112.096 -0.401 . . . . 0.0 112.096 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.83 29.58 0.47 Allowed 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.083 2.522 . . . . 0.0 113.774 -177.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -177.45 -70.86 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.866 0.365 . . . . 0.0 110.097 176.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.4 tpt -159.55 133.35 7.33 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -178.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -149.43 145.16 26.79 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.4 m -135.33 152.87 32.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.705 0.288 . . . . 0.0 110.647 -179.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.423 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.4 OUTLIER -96.76 138.38 34.41 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.753 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.6 mm -111.86 121.26 40.15 Favored Pre-proline 0 C--N 1.323 -0.565 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.311 -177.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.64 130.34 18.09 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.05 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 p -100.77 127.1 54.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.188 0.518 . . . . 0.0 110.667 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.469 HG12 HG11 ' A' ' 13' ' ' VAL . 83.0 t -95.5 123.07 47.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.128 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.458 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.2 mt-10 -92.19 109.69 21.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.479 0.657 . . . . 0.0 110.514 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.469 HG11 HG12 ' A' ' 11' ' ' VAL . 3.5 m -126.22 -176.12 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.423 -176.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -91.27 -25.64 19.38 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.429 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.5 pt-20 -171.51 170.54 5.75 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.75 176.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.409 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.1 mm? -74.1 151.63 88.26 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.521 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -59.41 171.54 2.44 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.374 2.049 . . . . 0.0 111.81 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.74 130.67 42.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.044 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.86 -6.33 29.32 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.375 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.76 164.45 14.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.923 0.392 . . . . 0.0 111.363 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -115.83 97.36 6.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.363 -177.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.499 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 35.1 ttp85 -101.76 145.69 28.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.424 -175.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 C--O 1.251 1.184 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.386 178.984 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.478 0.564 0 N-CA-C 110.858 -0.478 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -96.86 -29.46 13.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.413 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.9 mm-40 -88.1 -163.75 1.0 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.875 -176.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.19 142.38 58.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.376 0.608 . . . . 0.0 111.109 -177.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -72.63 153.76 41.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.0 -178.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -82.56 -16.16 49.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.627 -175.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -87.26 2.05 51.32 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.892 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 66.0 t -74.04 115.71 45.24 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.621 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -62.86 138.96 71.67 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.72 2.28 . . . . 0.0 112.843 -176.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . 0.51 ' H ' ' HB3' ' B' ' 56' ' ' ALA . 23.8 tt0 -93.8 100.99 13.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.449 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 77.4 m-85 -88.09 142.71 27.56 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.297 176.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -122.58 112.03 17.5 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.43 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 56.9 t -96.93 136.67 26.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.027 -171.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -132.52 132.62 42.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' MET . . . . . 0.524 ' HG2' HD13 ' B' ' 48' ' ' LEU . 2.1 ttt -113.57 138.82 49.61 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.473 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . 0.523 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 9.8 tmtm? -143.49 136.63 27.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.948 0.404 . . . . 0.0 110.706 -176.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -100.95 135.94 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.825 -177.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' PHE . . . . . 0.523 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.6 m-85 -111.83 155.73 23.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.987 0.422 . . . . 0.0 110.709 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -127.21 119.25 25.97 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.968 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 63.41 46.98 91.4 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.415 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -126.57 171.04 11.44 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.58 -2.74 18.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.96 0.409 . . . . 0.0 111.101 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' TYR . . . . . 0.505 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.2 OUTLIER -150.06 128.15 11.95 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.913 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -84.49 -28.54 26.69 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.216 -173.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.582 HD12 ' CD1' ' B' ' 50' ' ' ILE . 0.2 OUTLIER -133.59 135.78 44.49 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.65 -178.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -121.39 125.28 46.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.527 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' ILE . . . . . 0.582 ' CD1' HD12 ' B' ' 48' ' ' LEU . 1.8 mp -122.26 129.47 75.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.617 HD12 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -111.99 114.88 28.03 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.633 -178.119 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.18 104.53 14.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.449 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 14.9 pt-20 -108.41 153.08 23.8 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.339 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' ASN . . . . . 0.431 ' C ' HD21 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -97.3 110.33 22.9 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.528 -179.343 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -137.32 91.59 2.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.086 0.47 . . . . 0.0 110.815 178.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' ALA . . . . . 0.573 ' HB2' ' OG ' ' B' ' 59' ' ' SER . . . -138.42 156.19 73.53 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.534 176.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.18 -38.56 85.46 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.479 2.119 . . . . 0.0 111.495 176.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -132.68 73.33 1.52 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.345 -177.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' SER . . . . . 0.573 ' OG ' ' HB2' ' B' ' 56' ' ' ALA . 19.8 m -88.15 122.14 31.37 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.335 -178.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -130.34 73.86 80.87 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.848 175.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.93 137.89 17.99 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.419 2.079 . . . . 0.0 111.726 174.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -92.67 -62.64 1.35 Allowed 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.669 -177.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -159.24 172.17 18.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.956 -178.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -124.94 129.65 50.78 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.591 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 10.9 m -135.33 78.97 50.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . 0.467 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.3 Cg_endo -77.19 149.18 27.95 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.312 2.008 . . . . 0.0 112.088 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.437 ' HG ' ' C ' ' B' ' 66' ' ' PRO . 14.7 m -154.28 141.89 19.86 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.239 -179.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . 0.429 ' HB2' HD23 ' B' ' 75' ' ' LEU . 43.1 t80 -105.74 113.06 26.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.311 -178.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -95.63 106.1 18.16 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 176.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -56.42 -34.07 66.42 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.335 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.72 -45.21 58.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.859 -176.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . 0.524 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.0 mt-10 -112.31 5.31 18.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.096 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . 0.415 HD22 ' NE ' ' B' ' 87' ' ' ARG . 2.6 p-10 48.86 42.31 19.99 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.755 1.284 . . . . 0.0 111.6 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.524 HG13 ' O ' ' B' ' 72' ' ' GLU . 65.7 mt -118.75 135.77 58.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.168 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . 0.429 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -103.67 102.99 12.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.467 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -89.75 141.47 28.59 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -178.737 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 43.2 mm -97.97 -45.75 12.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.863 -176.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -156.53 176.48 12.65 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.013 -172.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.14 2.4 44.02 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -89.22 -43.94 10.63 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' LEU . . . . . 0.51 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.7 OUTLIER -157.0 153.46 28.03 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.495 0.664 . . . . 0.0 112.495 -176.258 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 15.8 p -124.28 146.91 48.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.812 176.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -108.18 102.35 45.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 120.888 0.375 . . . . 0.0 110.774 -177.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.477 ' HA ' HG12 ' B' ' 74' ' ' ILE . 60.5 Cg_endo -75.81 126.09 9.22 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.213 1.942 . . . . 0.0 112.127 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 83.5 mt -92.63 154.92 42.38 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.465 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -68.53 138.49 42.15 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 111.877 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' ARG . . . . . 0.424 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 9.1 mpt_? -80.69 -0.2 37.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -87.68 -10.35 51.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.386 0.612 . . . . 0.0 110.362 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' ILE . . . . . 0.49 ' CD1' HD22 ' B' ' 48' ' ' LEU . 57.4 mt -112.47 137.77 44.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.196 -175.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 64.6 t -83.19 111.73 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.917 177.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 92.7 t -118.69 131.32 71.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.597 0.713 . . . . 0.0 111.652 -174.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.35 159.89 41.34 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.228 176.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.64 -14.79 59.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.12 0.486 . . . . 0.0 111.55 -177.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.12 -26.19 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.077 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.38 -26.27 14.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.991 0.424 . . . . 0.0 110.582 -178.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 89.6 mt -69.0 113.4 4.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.764 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -110.41 108.15 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.875 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 50.7 mt -111.92 116.39 52.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.85 0.357 . . . . 0.0 110.861 -179.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -128.62 119.09 24.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.471 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' HIS . . . . . 0.458 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 13.1 t-80 -98.07 110.21 22.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.575 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' ILE . . . . . 0.541 HG22 ' H ' ' B' ' 104' ' ' GLU . 61.1 mt -91.28 104.57 15.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.649 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . 0.448 ' HG2' ' CE1' ' B' ' 100' ' ' HIS . 20.7 mtm180 -76.12 -28.24 57.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.895 -177.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -59.9 -42.16 93.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.798 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.541 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.0 tp10 -99.05 -0.93 40.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.174 -177.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 58.61 30.24 19.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.788 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 28.0 m -127.99 139.22 52.69 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.016 0.436 . . . . 0.0 111.155 -172.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.8 tp -109.05 120.23 41.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.296 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' TYR . . . . . 0.617 ' CE2' HD12 ' B' ' 51' ' ' LEU . 31.5 m-85 -102.08 127.0 49.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' ILE . . . . . 0.439 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 32.6 mm -113.87 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.798 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' TYR . . . . . 0.467 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.0 m-85 -122.32 126.5 48.22 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.505 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 55.4 mt . . . . . 0 C--O 1.245 0.865 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.309 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 1.5 m . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' B' ' 93' ' ' ALA . 17.5 m -119.57 143.1 32.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 120.829 0.347 . . . . 0.0 110.795 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.41 137.4 33.41 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.4 mm -105.41 121.05 47.49 Favored Pre-proline 0 C--N 1.319 -0.747 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.101 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.86 125.71 12.96 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.196 1.931 . . . . 0.0 111.956 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.492 HG23 HG22 ' B' ' 98' ' ' ILE . 2.2 p -103.31 127.98 56.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.551 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.566 HG12 HG13 ' A' ' 13' ' ' VAL . 44.2 t -95.04 125.17 47.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.816 178.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.455 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 35.3 mt-10 -93.25 96.05 9.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.637 0.732 . . . . 0.0 110.428 178.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.593 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 5.0 m -107.27 177.49 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.208 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.09 -14.02 24.61 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' HA ' HG12 ' B' ' 101' ' ' ILE . 12.9 pt-20 -178.61 166.83 1.77 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.596 -1.183 . . . . 0.0 109.677 173.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.1 mm? -73.73 149.6 88.21 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.532 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.03 168.18 21.35 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.432 2.088 . . . . 0.0 111.516 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.23 140.22 57.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -24.31 18.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.688 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -86.06 164.32 17.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.016 0.436 . . . . 0.0 111.087 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.59 95.49 5.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.645 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.524 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.4 ttt-85 . . . . . 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.0 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 . . . . . 0 N--CA 1.445 -0.724 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.468 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 83.5 m-85 -89.86 152.82 21.07 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -129.65 119.05 22.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 51.9 t -97.48 132.12 42.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.533 -175.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -125.88 132.91 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 176.187 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.649 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.7 ttt -118.14 139.34 51.4 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.505 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.509 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.3 tmtp? -144.9 132.73 21.19 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.309 -175.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.468 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -94.3 134.12 37.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.265 -176.55 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.509 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.9 m-85 -121.55 134.98 55.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.804 179.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -116.22 118.82 33.85 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.499 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.21 19.76 62.0 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.386 175.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -108.62 172.07 7.06 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 122.709 -0.289 . . . . 0.0 110.492 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.82 -20.37 63.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.343 0.592 . . . . 0.0 110.434 176.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.613 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -128.87 141.57 51.24 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.561 177.73 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.51 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -98.05 -21.45 16.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.229 0.537 . . . . 0.0 109.622 -176.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.649 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.09 132.83 29.02 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.235 -179.176 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 31.9 ttp180 -114.71 121.23 42.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.554 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.4 mp -118.52 128.54 75.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.549 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.3 mm? -114.98 121.09 42.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.442 -177.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -125.31 104.25 13.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.5 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.8 pt-20 -107.06 153.36 22.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.982 0.42 . . . . 0.0 110.614 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -98.14 107.41 19.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.129 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -130.05 93.78 3.57 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.458 0.647 . . . . 0.0 110.346 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.791 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.505 -179.412 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 . . . . . 0 N--CA 1.448 -0.536 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 16.0 m -129.95 79.89 72.25 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-O 121.153 0.502 . . . . 0.0 109.778 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.442 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 63.9 Cg_endo -79.68 150.41 21.49 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 111.784 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 67' ' ' SER . . . . . 0.506 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 14.1 m -154.03 142.38 20.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.491 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.415 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 59.7 t80 -104.56 118.47 36.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.493 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.475 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.2 p30 -100.05 115.27 29.35 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.748 177.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -64.25 -28.2 69.57 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.506 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.75 -46.63 70.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.407 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.499 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -112.46 2.44 16.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.568 -177.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' ASN . . . . . 0.444 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.1 p-10 48.37 45.56 20.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.38 1.072 . . . . 0.0 111.822 -175.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.499 HG13 ' O ' ' B' ' 72' ' ' GLU . 66.9 mt -124.07 137.95 55.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.152 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.412 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -102.9 104.21 14.43 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.5 p90 -93.07 142.1 27.67 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.84 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.1 mm -88.24 -54.02 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 -177.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 41.3 m-20 -153.25 176.91 11.43 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.3 40.63 1.75 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.56 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' LYS . . . . . 0.639 ' HD3' ' O ' ' B' ' 80' ' ' LYS . 0.0 OUTLIER -131.23 -36.53 1.3 Allowed 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.517 ' HG ' ' HG3' ' B' ' 80' ' ' LYS . 0.2 OUTLIER -154.53 153.53 31.61 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.441 0.638 . . . . 0.0 111.704 175.37 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 21.2 p -130.47 148.99 52.34 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.274 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mm -107.84 102.53 45.79 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 120.819 0.342 . . . . 0.0 110.178 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.85 135.13 17.2 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.208 1.939 . . . . 0.0 112.117 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -97.59 141.09 22.47 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.559 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -64.76 139.62 63.77 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.986 1.791 . . . . 0.0 110.761 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.444 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.6 mpt_? -70.82 -0.99 10.2 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.789 -174.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -79.28 -16.79 55.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.534 0.683 . . . . 0.0 109.714 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -110.04 137.1 43.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.6 p -92.32 112.37 25.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' VAL . . . . . 0.415 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.5 p -121.38 139.32 48.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.306 0.574 . . . . 0.0 111.218 -174.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.427 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -140.5 164.69 29.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.011 -178.983 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.451 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -59.83 -23.53 63.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.058 0.456 . . . . 0.0 111.577 -176.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.06 -16.48 43.63 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.279 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.427 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 26.7 t70 -102.51 -24.27 13.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.683 0.754 . . . . 0.0 109.563 -176.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.442 HG22 HG13 ' B' ' 98' ' ' ILE . 81.3 mt -72.78 115.55 13.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.306 177.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.461 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -109.47 106.49 16.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.718 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.492 HG22 HG23 ' A' ' 10' ' ' VAL . 57.2 mt -110.99 121.14 63.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.447 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -134.54 124.43 25.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.367 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.455 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 22.5 t-80 -105.5 113.09 26.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.715 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.593 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 3.0 mp -89.37 118.39 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 175.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 62.8 mtp85 -81.76 -23.71 36.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.866 -177.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -57.94 -43.33 86.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.14 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.512 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.0 pt-20 -110.0 0.98 18.72 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.456 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 58.27 38.49 26.08 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.63 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.5 HG23 ' HB3' ' B' ' 53' ' ' GLU . 29.1 m -117.73 137.92 52.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 120.921 0.391 . . . . 0.0 110.674 -176.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.25 114.35 28.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.875 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.549 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.2 m-85 -93.48 125.44 38.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.377 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.542 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 44.0 mm -115.04 121.95 68.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.109 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.461 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.0 m-85 -121.8 127.83 51.02 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.613 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.3 mt . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.783 -0.627 . . . . 0.0 109.767 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.0 p . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.496 HG21 ' HB2' ' B' ' 93' ' ' ALA . 20.3 m -122.51 141.01 44.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.748 -176.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.434 ' HA ' ' CB ' ' B' ' 67' ' ' SER . 0.3 OUTLIER -88.19 138.03 31.81 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.061 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.572 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.0 mm -107.59 120.92 45.87 Favored Pre-proline 0 C--N 1.317 -0.827 0 C-N-CA 120.634 -0.427 . . . . 0.0 109.887 -176.32 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.12 130.63 21.84 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.503 2.135 . . . . 0.0 112.469 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.9 t -89.67 131.84 35.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.645 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.444 ' HB ' ' CD2' ' B' ' 99' ' ' PHE . 47.6 t -97.48 111.22 26.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 172.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.493 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.5 mt-10 -92.64 107.19 19.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.629 0.728 . . . . 0.0 110.789 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.4 m -135.43 -174.33 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.299 -177.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.523 ' OD1' ' HB2' ' B' ' 103' ' ' LYS . 24.5 m-20 -105.61 -10.07 17.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.887 0.375 . . . . 0.0 110.547 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -165.19 156.28 14.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.687 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.481 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -84.77 156.2 61.45 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.702 0.287 . . . . 0.0 110.722 -179.1 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -54.88 170.55 0.61 Allowed 'Trans proline' 0 C--O 1.238 0.501 0 C-N-CA 123.464 2.776 . . . . 0.0 113.161 172.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.24 142.22 58.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.397 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.56 -9.7 66.7 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.24 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -88.11 147.1 25.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.274 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -101.38 102.89 13.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.434 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.481 ' HD2' HD22 ' A' ' 16' ' ' LEU . 14.5 ttt180 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.049 -172.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 121.381 0.61 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.6 m-85 -84.28 154.48 22.95 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.529 176.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -123.59 113.7 19.04 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -95.45 131.43 42.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.984 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.55 142.95 51.24 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.567 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -124.26 140.64 52.77 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.015 -0.274 . . . . 0.0 110.582 -176.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.9 tmtp? -145.3 133.82 22.0 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.704 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.473 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.92 137.49 34.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.713 179.366 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -117.54 150.67 38.58 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -125.27 111.17 14.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.958 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.59 54.52 6.62 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.584 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.81 171.45 14.48 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 174.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.78 66.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.687 0.756 . . . . 0.0 110.206 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.692 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -124.84 135.56 53.03 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.923 -178.756 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.511 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.5 mppt? -96.07 -23.53 16.75 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.619 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -136.66 130.3 31.97 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.735 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -118.63 123.46 45.04 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.836 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.619 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -120.04 130.85 73.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.73 119.95 38.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -123.74 103.48 12.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.517 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -108.86 153.7 23.15 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.693 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -100.52 114.43 28.05 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.501 -178.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.56 ' O ' ' HD3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -137.61 90.95 2.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.664 0.745 . . . . 0.0 111.318 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.711 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.63 177.141 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 . . . . . 0 CA--C 1.517 -0.316 0 CA-C-O 120.727 0.298 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 11.5 t -135.61 79.86 46.08 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.67 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 66.2 Cg_endo -87.9 160.43 7.47 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.068 2.512 . . . . 0.0 113.168 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 67' ' ' SER . . . . . 0.434 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 38.8 p -161.96 144.44 11.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.731 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.419 ' HB2' HD23 ' B' ' 75' ' ' LEU . 57.2 t80 -103.47 119.58 39.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.787 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -100.58 116.06 31.63 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.503 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -66.98 -24.91 66.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.891 -176.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.01 -43.26 86.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.708 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.457 ' O ' HG13 ' B' ' 74' ' ' ILE . 10.3 mt-10 -112.45 4.76 17.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' ASN . . . . . 0.412 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.4 p-10 48.24 43.14 18.67 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 124.524 1.14 . . . . 0.0 111.067 -176.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.457 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.5 mt -119.25 134.67 62.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.269 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.419 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.5 tm? -102.92 103.34 13.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.431 ' HB2' ' HB3' ' B' ' 82' ' ' SER . 0.0 OUTLIER -88.8 144.91 25.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -178.173 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 77' ' ' ILE . . . . . 0.421 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 42.5 mm -98.51 -57.45 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.155 0.502 . . . . 0.0 110.927 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -147.07 179.06 7.89 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.22 4.76 10.72 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.286 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -93.86 -45.1 7.79 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -151.8 153.23 33.85 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.557 0.694 . . . . 0.0 112.452 -177.464 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' B' ' 76' ' ' TYR . 10.6 p -126.47 147.43 49.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.891 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 52.1 mm -106.83 109.12 62.93 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.936 0.398 . . . . 0.0 110.751 -177.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.416 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.9 Cg_endo -81.49 137.15 10.18 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.262 1.974 . . . . 0.0 112.024 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.91 150.18 36.83 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.949 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.463 ' HG2' HD12 ' B' ' 89' ' ' ILE . 28.6 Cg_endo -63.22 142.15 85.26 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.537 2.158 . . . . 0.0 111.552 176.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.412 ' NE ' HD21 ' B' ' 73' ' ' ASN . 10.0 mpt_? -79.19 -2.83 42.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.069 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.33 2.33 56.7 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.786 0.327 . . . . 0.0 111.083 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.463 HD12 ' HG2' ' B' ' 86' ' ' PRO . 58.1 mt -121.95 138.28 52.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.506 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.26 122.91 38.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 52.3 t -126.14 130.16 72.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.207 0.527 . . . . 0.0 111.299 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.2 OUTLIER -141.31 161.44 37.89 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.725 177.427 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.496 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -65.45 -12.6 54.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.201 -175.176 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.62 -9.23 47.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.213 0.53 . . . . 0.0 110.882 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.474 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 12.7 t70 -111.75 -24.82 9.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.673 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.3 mt -73.08 115.06 13.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.949 176.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.458 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.9 mmmm -111.35 101.92 10.35 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.949 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.572 HD12 ' HB ' ' A' ' 8' ' ' ILE . 32.8 mt -101.85 122.6 54.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 111.343 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.444 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 70.7 m-85 -133.21 118.13 18.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.252 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.493 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 20.2 t-80 -100.4 107.78 19.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.821 0.343 . . . . 0.0 110.495 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.63 HD12 ' CE1' ' B' ' 108' ' ' TYR . 49.8 mt -86.85 102.56 12.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.18 0.514 . . . . 0.0 110.021 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -17.34 63.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.658 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 103' ' ' LYS . . . . . 0.523 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 30.8 tttm -67.19 -48.91 66.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.998 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.606 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.4 mm-40 -101.32 4.93 42.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.159 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? 55.28 37.08 28.36 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.652 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 40.0 m -125.25 130.6 52.39 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.066 -174.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.54 117.69 33.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.629 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.63 ' CE1' HD12 ' B' ' 101' ' ' ILE . 10.1 m-85 -95.99 124.39 39.98 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.113 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.571 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.1 mm -114.81 115.92 50.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.869 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.505 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.3 m-85 -116.4 125.11 51.58 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 176.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.692 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 58.7 mt . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.94 -0.552 . . . . 0.0 109.741 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.438 HG21 ' HB2' ' B' ' 93' ' ' ALA . 19.7 m -130.81 145.89 34.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.941 0.4 . . . . 0.0 110.891 -177.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 136.15 33.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.899 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.459 ' HB ' HD12 ' B' ' 98' ' ' ILE . 6.5 mm -105.19 121.08 47.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.309 -178.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.03 130.53 15.58 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.433 2.089 . . . . 0.0 112.26 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.409 HG13 HG22 ' B' ' 98' ' ' ILE . 46.4 t -86.95 133.3 30.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.576 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.511 HG12 HG13 ' A' ' 13' ' ' VAL . 98.9 t -98.01 119.94 46.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 173.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.415 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 28.8 mt-10 -93.18 111.99 23.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.566 0.698 . . . . 0.0 110.697 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.511 HG13 HG12 ' A' ' 11' ' ' VAL . 4.8 m -129.6 170.46 18.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.535 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -91.61 -20.24 21.86 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -168.76 155.9 7.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.12 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.446 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -78.7 149.32 74.3 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -67.56 172.23 10.71 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.328 2.019 . . . . 0.0 111.44 177.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.74 135.86 57.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.163 0.506 . . . . 0.0 111.439 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.0 -17.26 27.31 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.793 -175.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -94.06 146.73 23.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.939 0.4 . . . . 0.0 111.074 178.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -101.27 95.22 6.38 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.103 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HD2' HD22 ' A' ' 16' ' ' LEU . 18.3 ttt180 . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.841 -178.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.48 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 29.9 tt0 . . . . . 0 N--CA 1.446 -0.636 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.541 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 92.5 m-85 -90.47 142.03 28.15 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.692 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.443 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 35.2 tt0 -112.4 107.15 15.84 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.57 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.6 p -94.91 127.26 47.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.261 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.443 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -124.26 121.44 35.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.407 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.572 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.5 ttt -107.65 139.11 42.7 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 -175.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.548 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 8.4 tmtm? -144.54 134.87 24.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.853 0.358 . . . . 0.0 110.515 -174.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.509 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -94.76 134.17 37.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -178.808 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.548 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 34.5 m-85 -119.15 139.4 51.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.985 0.422 . . . . 0.0 111.128 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -130.41 116.29 18.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.597 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 90.82 32.27 9.29 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.95 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.79 170.85 13.35 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.43 64.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.401 0.619 . . . . 0.0 110.448 177.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.566 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.3 p90 -126.97 147.58 50.11 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.795 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.509 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -104.57 -18.62 14.27 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.24 0.543 . . . . 0.0 109.742 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.629 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.83 133.34 31.9 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.398 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -119.77 131.12 55.26 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.629 HD11 HD12 ' B' ' 48' ' ' LEU . 1.9 mp -128.19 128.45 68.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.581 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.9 mm? -111.55 119.92 40.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.1 mp -126.88 104.07 12.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.541 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -111.43 153.76 25.65 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.942 0.401 . . . . 0.0 110.55 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -99.06 100.32 11.46 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.488 -179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.415 ' HD3' ' HB2' ' B' ' 35' ' ' GLU . 18.4 ptmt -129.28 93.5 3.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.6 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 56' ' ' ALA . . . . . 0.48 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.321 -0.669 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.106 176.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' PHE . . . . . 0.404 ' CD1' HD12 ' B' ' 107' ' ' LEU . 72.9 m-85 . . . . . 0 N--CA 1.453 -0.318 0 CA-C-O 120.655 0.264 . . . . 0.0 110.546 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.3 m -133.02 79.21 63.42 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 176.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -83.29 153.38 14.07 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.78 2.32 . . . . 0.0 112.436 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.2 m -156.65 145.95 20.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.213 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.448 ' HB2' HD23 ' B' ' 75' ' ' LEU . 49.8 t80 -108.34 124.42 50.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.599 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -105.28 116.71 32.41 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.646 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -66.7 -25.89 66.76 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.687 -176.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.8 -50.99 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.547 -178.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.9 mt-10 -112.68 7.56 18.71 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.486 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 50.66 42.73 27.51 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 124.268 0.98 . . . . 0.0 111.429 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 68.1 mt -117.75 138.07 49.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.457 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.448 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -105.03 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.49 140.17 29.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.7 mm -92.85 -57.06 4.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.958 -176.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' B' ' 80' ' ' LYS . 57.8 m-20 -151.95 -177.81 6.37 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -178.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.19 20.93 2.94 Favored Glycine 0 C--O 1.225 -0.409 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.964 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' LYS . . . . . 0.415 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.7 mmtt -110.62 -38.36 5.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -160.47 153.36 21.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.876 178.052 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.2 t -127.92 150.37 49.91 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.584 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mm -114.81 100.81 53.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.952 0.405 . . . . 0.0 111.045 -175.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.408 ' HA ' HG12 ' B' ' 74' ' ' ILE . 21.4 Cg_exo -67.92 136.55 38.67 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.712 2.275 . . . . 0.0 112.33 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 63.6 mt -103.65 153.82 38.37 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.092 -178.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.447 ' HG2' HD12 ' B' ' 89' ' ' ILE . 46.4 Cg_endo -72.33 138.69 30.63 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.125 1.883 . . . . 0.0 111.787 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 1.8 mmt180 -74.9 2.18 10.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.804 -177.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -86.91 -18.41 30.88 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.415 0.626 . . . . 0.0 110.053 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.447 HD12 ' HG2' ' B' ' 86' ' ' PRO . 66.7 mt -104.38 134.01 46.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.303 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 48.3 t -82.46 111.57 19.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.85 130.93 73.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.324 0.583 . . . . 0.0 111.461 -172.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.418 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.82 163.36 33.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.358 175.137 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.438 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.21 -19.01 64.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.913 0.387 . . . . 0.0 111.799 -177.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.3 -13.3 55.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.961 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 23.3 t0 -109.04 -20.69 12.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.573 0.701 . . . . 0.0 109.881 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.418 HG22 HG13 ' B' ' 98' ' ' ILE . 80.3 mt -76.73 116.27 19.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.786 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.5 mmmt -109.62 104.07 13.03 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.254 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.459 HD12 ' HB ' ' A' ' 8' ' ' ILE . 49.1 mt -107.82 121.38 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -130.71 121.12 24.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.257 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.415 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 30.1 t-80 -104.5 114.76 29.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.898 0.38 . . . . 0.0 110.597 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.518 HG22 ' H ' ' B' ' 104' ' ' GLU . 58.7 mt -90.96 100.55 11.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -69.69 -24.48 63.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.148 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -59.23 -47.92 83.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.321 0.581 . . . . 0.0 110.494 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.518 ' H ' HG22 ' B' ' 101' ' ' ILE . 13.7 mm-40 -100.88 0.79 39.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.819 -175.424 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 57.1 33.5 23.42 Favored 'General case' 0 N--CA 1.46 0.072 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.66 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.418 ' CG2' HD12 ' B' ' 51' ' ' LEU . 46.1 m -119.62 130.13 54.95 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -174.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 107' ' ' LEU . . . . . 0.406 HD21 ' CG2' ' B' ' 98' ' ' ILE . 0.5 OUTLIER -102.27 121.27 41.94 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.03 178.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.581 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.7 m-85 -98.97 126.79 44.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.155 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.511 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.3 mm -115.36 121.4 67.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.899 175.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 82.2 m-85 -122.55 124.32 43.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.668 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.566 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.819 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.901 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.3 p . . . . . 0 N--CA 1.45 -0.46 0 CA-C-O 120.92 0.39 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -125.84 142.63 41.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.324 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.51 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -91.5 140.05 30.12 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.352 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.5 mm -110.35 123.52 35.67 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 -176.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -71.39 125.51 11.35 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.077 1.851 . . . . 0.0 111.979 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.486 HG23 HG22 ' B' ' 98' ' ' ILE . 1.9 p -97.65 119.96 46.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 13' ' ' VAL . 61.5 t -91.29 117.13 33.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -84.72 111.91 20.01 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.325 0.583 . . . . 0.0 110.271 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.559 HG13 HG12 ' A' ' 11' ' ' VAL . 3.3 m -124.55 -174.77 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.58 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -93.73 -26.77 16.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -171.14 167.19 7.16 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.344 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.494 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.3 mm? -71.04 143.49 88.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.636 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.92 174.48 11.15 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.928 2.419 . . . . 0.0 112.259 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.85 139.77 12.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.459 178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.16 -9.42 57.85 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.429 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -102.86 167.52 9.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.991 0.424 . . . . 0.0 111.953 -179.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -127.53 98.92 5.39 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.575 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' HB2' HD23 ' A' ' 16' ' ' LEU . 26.5 ttp85 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.4 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 . . . . . 0 N--CA 1.447 -0.586 0 CA-C-O 121.255 0.55 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 79.1 m-85 -85.76 145.16 27.37 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.029 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -123.47 112.75 17.88 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.634 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -100.83 131.39 48.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.694 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -120.81 150.51 40.91 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.581 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.3 ttt -135.63 134.49 39.31 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -176.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 10.2 tmtt? -142.83 132.55 23.94 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.996 -0.281 . . . . 0.0 110.527 -172.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.477 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.5 OUTLIER -95.01 133.01 39.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.132 0.492 . . . . 0.0 111.006 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.407 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 14.3 m-85 -111.85 140.33 46.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.012 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -118.4 121.97 41.64 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.275 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.01 46.54 43.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.638 -179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.09 170.94 14.26 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.49 -14.41 62.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.106 0.479 . . . . 0.0 110.768 178.188 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -134.82 137.69 43.56 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.611 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.531 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -96.32 -23.2 16.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.519 . . . . 0.0 109.841 -173.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.581 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.35 133.51 34.96 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.448 -176.972 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -119.31 122.46 41.92 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.569 ' CD1' HD12 ' B' ' 48' ' ' LEU . 2.4 mp -117.4 131.56 69.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.634 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 3.4 mm? -117.52 118.03 31.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 -176.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -122.71 103.74 13.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.9 pt-20 -110.42 153.41 25.03 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.371 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -102.12 108.82 20.36 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.365 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -134.01 92.84 3.01 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.651 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.663 175.537 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 . . . . . 0 N--CA 1.451 -0.383 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 50.6 m -138.3 79.97 29.43 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.449 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 71.9 Cg_endo -81.38 153.31 18.25 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.634 2.223 . . . . 0.0 113.102 -178.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 67' ' ' SER . . . . . 0.508 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 99.2 p -159.09 150.38 20.27 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.206 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.471 ' HB2' HD23 ' B' ' 75' ' ' LEU . 45.0 t80 -108.83 128.01 54.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.597 -177.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.568 ' O ' ' HA ' ' B' ' 73' ' ' ASN . 0.1 OUTLIER -108.2 128.11 54.43 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 176.512 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -75.1 -25.41 58.51 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.297 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.402 ' HB3' ' OD1' ' B' ' 69' ' ' ASN . . . -60.79 -51.45 69.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.816 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.52 ' O ' HD13 ' B' ' 74' ' ' ILE . 11.0 mm-40 -103.62 -10.6 18.28 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' ASN . . . . . 0.568 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 1.8 p-10 59.95 45.34 12.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.499 1.143 . . . . 0.0 110.183 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.52 HD13 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.7 143.8 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 113.914 -1.494 . . . . 0.0 109.099 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.471 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.2 tm? -110.27 97.83 7.21 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.1 OUTLIER -87.42 143.69 27.11 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.037 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 45.3 mm -95.84 -56.08 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.417 -171.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -160.46 24.0 0.15 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -174.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.1 -22.94 5.58 Favored Glycine 0 C--N 1.322 -0.246 0 C-N-CA 120.122 -1.037 . . . . 0.0 112.774 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -79.48 -28.61 41.48 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.451 HD21 ' CB ' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -162.45 153.54 17.63 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.325 175.031 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 63.5 p -124.3 150.61 45.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.571 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -106.93 100.14 30.15 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.809 0.338 . . . . 0.0 110.328 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.519 ' HA ' HD12 ' B' ' 74' ' ' ILE . 25.9 Cg_exo -65.91 131.5 27.44 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.686 2.257 . . . . 0.0 112.005 177.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 87.6 mt -101.72 151.37 37.89 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.261 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.35 143.24 31.15 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.647 2.231 . . . . 0.0 112.206 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -3.38 49.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.5 -178.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -82.44 -9.62 59.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 59.9 mt -118.88 136.49 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.429 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.7 p -87.55 115.11 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 48.1 t -123.06 136.18 60.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.095 0.474 . . . . 0.0 111.248 -174.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.597 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -140.48 164.54 29.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.965 178.396 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.16 -23.83 65.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.652 -176.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.67 -12.03 56.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.769 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.597 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 14.4 t0 -104.06 -24.64 13.19 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.787 0.803 . . . . 0.0 109.244 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.36 117.69 24.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.219 -179.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.6 mmmt -112.09 108.0 17.12 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.985 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.486 HG22 HG23 ' A' ' 10' ' ' VAL . 47.2 mt -111.63 118.26 57.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -132.45 121.83 24.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.269 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.516 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 38.4 t-80 -107.02 112.09 24.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.958 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.597 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.9 mp -85.18 108.35 16.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -76.12 -24.9 54.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.119 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.5 -46.5 89.73 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.597 ' H ' HG22 ' B' ' 101' ' ' ILE . 14.6 mt-10 -92.12 -2.2 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.28 0.562 . . . . 0.0 110.096 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 47.6 mtp180 54.23 38.91 30.21 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.287 -177.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.471 HG23 ' HB3' ' B' ' 53' ' ' GLU . 32.8 m -123.34 131.95 53.83 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.82 -172.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.73 114.89 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.454 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.616 ' CE2' HD11 ' B' ' 51' ' ' LEU . 48.6 m-85 -93.67 120.87 34.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.05 177.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.544 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.4 mm -110.88 123.85 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.974 177.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.443 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 84.7 m-85 -122.69 129.12 51.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 63.8 mt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.738 -0.649 . . . . 0.0 109.618 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 27.2 p . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 121.343 0.592 . . . . 0.0 112.316 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.2 m -128.75 142.54 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.549 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.413 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -86.11 137.81 32.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 -177.918 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 mm -109.04 118.66 50.84 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.71 123.89 10.19 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.122 1.881 . . . . 0.0 111.849 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.5 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -96.14 127.92 47.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.773 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.514 HG12 HG13 ' A' ' 13' ' ' VAL . 58.6 t -92.12 128.21 43.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.71 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.436 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 39.5 mt-10 -97.49 109.11 21.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.328 0.585 . . . . 0.0 110.322 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.5 m -131.76 176.14 9.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.553 -177.216 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -101.2 -9.73 21.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.652 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -164.3 156.38 16.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.926 176.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.489 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -83.78 153.7 64.37 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.12 177.336 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -51.89 167.07 0.5 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.38 2.72 . . . . 0.0 113.318 173.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -72.3 130.54 41.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.99 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.6 29.91 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -173.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.28 153.05 18.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.071 0.462 . . . . 0.0 110.762 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -110.25 97.75 7.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.872 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.559 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 53.1 ttp85 . . . . . 0 C--N 1.324 -0.505 0 CA-C-O 121.071 0.462 . . . . 0.0 111.683 -176.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 . . . . . 0 N--CA 1.444 -0.73 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 90.4 m-85 -86.89 152.66 22.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.478 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -120.53 110.58 16.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.009 176.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 57.3 t -92.96 124.21 45.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.397 -178.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -121.57 137.92 54.53 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.107 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.526 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -120.43 139.83 52.26 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 -175.748 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.517 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.2 135.72 21.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.678 0.275 . . . . 0.0 110.295 -176.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.517 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -97.66 135.48 39.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 -178.128 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -118.26 147.53 43.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.458 177.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -133.72 119.8 19.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.065 0.459 . . . . 0.0 110.494 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.85 26.97 52.19 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.109 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.79 171.25 8.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.91 -13.98 60.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.133 0.492 . . . . 0.0 110.98 179.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.572 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -133.09 146.33 51.55 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 176.537 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.52 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -100.95 -22.26 14.84 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.23 0.538 . . . . 0.0 109.726 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.562 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.94 135.42 36.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.225 -178.977 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -120.46 129.16 53.75 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -123.16 131.65 72.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.63 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -115.14 117.13 29.67 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.2 102.9 13.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.493 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.9 pt-20 -109.05 153.32 23.81 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.896 0.379 . . . . 0.0 110.168 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -98.62 113.85 26.07 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.91 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.404 ' NZ ' ' HB2' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.02 93.23 3.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.368 0.604 . . . . 0.0 110.562 178.066 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.757 179.559 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.0 t -131.96 78.17 70.22 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.536 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 81.6 Cg_endo -81.1 151.39 18.2 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.766 2.31 . . . . 0.0 113.621 -178.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 15.2 m -156.08 150.53 25.76 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.035 176.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.479 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 40.1 t80 -108.02 124.35 50.04 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.714 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.469 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.3 p30 -103.3 112.36 25.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.109 0.481 . . . . 0.0 110.55 176.079 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.61 -33.01 73.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.575 -177.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.64 -48.92 68.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.623 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.56 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.4 mt-10 -110.54 5.93 21.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.411 -176.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 48.51 43.16 19.82 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.397 1.06 . . . . 0.0 111.587 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.56 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.2 mt -118.15 143.32 29.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.555 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.426 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -109.32 101.81 10.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.536 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -88.6 142.81 27.39 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.826 -178.086 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 47.5 mm -96.05 -48.92 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.576 -177.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -165.71 -168.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.584 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.75 -4.94 59.7 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.007 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -86.5 -40.12 15.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.454 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -161.6 154.02 20.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.602 0.715 . . . . 0.0 112.675 -179.762 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.9 p -123.58 148.25 46.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.415 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.6 mm -105.23 105.21 51.06 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 120.621 0.248 . . . . 0.0 110.536 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.477 ' HA ' HG12 ' B' ' 74' ' ' ILE . 59.1 Cg_endo -74.85 131.58 14.64 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.138 1.892 . . . . 0.0 111.77 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 65.9 mt -99.79 154.08 37.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.031 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.43 139.91 46.57 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.335 2.023 . . . . 0.0 112.061 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.403 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 9.7 mpt_? -77.59 -6.85 55.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -84.76 -12.43 53.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.302 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.6 mt -113.96 133.83 58.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.986 -176.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.5 127.78 39.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.481 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 91' ' ' VAL . . . . . 0.479 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -137.35 138.91 44.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.259 0.552 . . . . 0.0 111.524 -174.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -140.33 166.38 24.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.044 178.951 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.09 -22.57 64.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.147 0.499 . . . . 0.0 111.572 -177.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.81 -9.75 55.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.114 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.408 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 31.0 t70 -107.08 -23.76 12.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.755 0.788 . . . . 0.0 109.688 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.407 HG22 HG13 ' B' ' 98' ' ' ILE . 76.9 mt -74.74 116.69 17.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.443 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.4 mmmm -111.34 105.36 13.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.894 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.5 HG22 HG23 ' A' ' 10' ' ' VAL . 56.3 mt -110.17 120.55 61.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.994 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.23 119.2 21.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.436 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.4 t-80 -97.14 108.03 20.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.675 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.555 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 46.8 mt -86.7 98.01 6.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 172.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -72.99 -20.59 60.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -58.15 -49.09 78.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.472 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.474 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.4 mm-40 -99.88 1.14 42.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.538 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 55.02 36.13 26.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.269 -175.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.493 HG23 ' HB3' ' B' ' 53' ' ' GLU . 22.7 m -116.73 126.4 53.1 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.35 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 54.3 tp -101.28 121.72 42.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.662 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.63 ' CE2' HD11 ' B' ' 51' ' ' LEU . 21.2 m-85 -101.97 128.29 48.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.384 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.6 mm -116.3 122.0 68.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.66 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.49 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 86.0 m-85 -122.44 126.35 47.74 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.572 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--N 1.319 -0.752 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.715 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 28.5 p . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.4 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.3 m -124.22 140.73 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.068 0.461 . . . . 0.0 110.642 -178.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 135.1 35.03 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.157 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.4 mm -112.07 114.18 51.47 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -71.5 135.81 27.19 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 121.869 1.712 . . . . 0.0 111.08 175.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.496 HG23 HG22 ' B' ' 98' ' ' ILE . 1.4 p -100.41 128.59 52.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.748 -177.343 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.506 HG12 HG13 ' A' ' 13' ' ' VAL . 47.6 t -87.26 112.68 23.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.766 179.242 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.7 mt-10 -92.13 106.76 18.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.444 0.64 . . . . 0.0 110.223 179.188 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.506 HG13 HG12 ' A' ' 11' ' ' VAL . 2.2 m -129.21 -172.57 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.084 -175.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -96.87 -30.22 13.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.143 0.497 . . . . 0.0 109.661 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -149.66 166.05 30.51 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.233 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.8 mm? -80.05 141.47 54.5 Favored Pre-proline 0 C--N 1.316 -0.874 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.198 173.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.71 166.47 0.23 Allowed 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 123.485 2.79 . . . . 0.0 113.029 172.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -68.56 132.34 46.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.578 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.1 -2.17 29.91 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.638 -174.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -102.46 175.18 5.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.996 0.427 . . . . 0.0 111.142 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.59 112.33 12.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.707 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.494 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.5 ttp85 . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 178.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 . . . . . 0 N--CA 1.443 -0.796 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.453 ' HB2' HD21 ' B' ' 81' ' ' LEU . 96.1 m-85 -90.5 154.92 19.27 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.372 -178.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -120.0 108.9 14.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.068 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 92.1 t -91.11 129.36 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.008 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -127.07 142.75 51.45 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 176.791 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.559 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.3 ttt -123.97 141.21 52.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.637 -175.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.9 tmtt? -140.92 133.47 28.57 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.562 -176.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.46 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 9.2 mpt_? -99.34 138.73 36.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.995 0.426 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.404 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 53.8 m-85 -118.77 167.32 11.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.448 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.31 105.23 4.02 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.013 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.84 46.96 6.9 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.891 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.98 172.19 12.96 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 -25.27 64.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.554 0.692 . . . . 0.0 110.492 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.571 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -131.8 141.95 49.6 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.684 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.501 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.05 -21.42 15.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.266 0.555 . . . . 0.0 109.679 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.608 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.66 135.29 33.09 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.781 -178.469 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -124.51 133.6 53.28 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.608 HD11 HD12 ' B' ' 48' ' ' LEU . 2.4 mp -125.45 132.37 71.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.474 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.4 mm? -113.55 121.99 45.89 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.3 103.13 11.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 177.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.42 ' HB3' HG23 ' B' ' 106' ' ' THR . 14.0 pt-20 -114.99 153.41 30.67 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.106 0.479 . . . . 0.0 110.305 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -95.94 110.2 22.45 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.423 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -130.04 94.11 3.64 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.868 0.842 . . . . 0.0 110.536 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.084 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.515 179.437 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -136.92 79.64 38.34 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-O 121.096 0.474 . . . . 0.0 109.782 175.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -80.03 158.38 23.83 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.982 2.455 . . . . 0.0 113.486 -178.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 90.8 p -158.56 147.89 19.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.074 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.441 ' HB2' HD23 ' B' ' 75' ' ' LEU . 53.8 t80 -106.95 117.97 35.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.196 0.522 . . . . 0.0 110.847 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.486 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.7 OUTLIER -100.02 110.18 22.5 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.526 176.539 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -60.52 -33.58 72.85 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.66 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -51.79 -44.14 63.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.719 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.446 ' O ' HG13 ' B' ' 74' ' ' ILE . 4.1 mm-40 -111.56 4.0 18.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.46 44.9 17.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.422 -176.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.446 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.6 mt -121.74 135.05 63.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.163 -178.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.441 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -100.84 100.85 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.0 OUTLIER -84.83 144.63 28.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -177.757 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.8 mm -98.41 -59.57 3.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.299 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -144.88 -178.04 5.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.419 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.98 3.61 27.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.749 176.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -90.21 -40.56 12.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.505 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.4 pp -160.22 153.29 21.68 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.624 -0.717 . . . . 0.0 112.224 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 23.9 p -121.07 147.56 45.36 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.65 174.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.0 mm -102.71 103.99 36.02 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.852 0.358 . . . . 0.0 110.344 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.432 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.3 Cg_endo -81.88 130.38 6.62 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.281 1.988 . . . . 0.0 112.599 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -96.86 147.2 32.57 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.955 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.465 ' HG2' HD12 ' B' ' 89' ' ' ILE . 31.2 Cg_endo -65.36 140.65 64.77 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.199 1.932 . . . . 0.0 111.343 175.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.4 ' NH1' ' HA ' ' B' ' 86' ' ' PRO . 0.1 OUTLIER -73.14 -5.74 41.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.429 -175.851 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -81.5 -11.57 59.15 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.311 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.465 HD12 ' HG2' ' B' ' 86' ' ' PRO . 58.8 mt -114.84 136.64 50.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.902 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.1 p -84.51 113.41 23.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.215 0.531 . . . . 0.0 109.971 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 62.1 t -120.49 130.72 74.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-O 121.122 0.487 . . . . 0.0 111.128 -175.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.403 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.43 164.43 30.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.912 177.962 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.4 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.22 -18.01 63.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.871 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.4 -14.82 48.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.831 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.403 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 20.4 t70 -108.67 -23.98 11.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.837 -175.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.442 HG22 HG13 ' B' ' 98' ' ' ILE . 80.5 mt -73.45 115.33 14.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.18 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -110.09 98.82 8.01 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.575 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.496 HG22 HG23 ' A' ' 10' ' ' VAL . 39.2 mt -99.84 116.72 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.005 0.431 . . . . 0.0 110.766 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -130.66 121.34 25.38 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.095 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.453 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 27.8 t-80 -109.54 125.29 52.35 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.047 0.451 . . . . 0.0 110.882 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.54 HG22 ' H ' ' B' ' 104' ' ' GLU . 85.4 mt -104.12 113.02 39.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.973 177.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.51 -23.38 61.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.709 0.29 . . . . 0.0 110.573 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.54 ' H ' HG22 ' B' ' 101' ' ' ILE . 42.7 mt-10 -95.23 0.67 54.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.135 0.493 . . . . 0.0 109.985 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 51.71 37.29 19.79 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.207 -173.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.42 HG23 ' HB3' ' B' ' 53' ' ' GLU . 62.4 m -121.52 133.98 55.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.535 -173.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 107' ' ' LEU . . . . . 0.448 ' HG ' ' CD2' ' B' ' 100' ' ' HIS . 0.4 OUTLIER -100.33 118.16 36.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.964 177.9 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.515 ' HB3' ' CE1' ' B' ' 110' ' ' TYR . 29.8 m-85 -98.12 119.05 36.09 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.9 179.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.492 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.3 mm -108.99 123.0 64.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.843 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 67.7 m-85 -122.53 126.64 48.21 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.571 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.776 -0.631 . . . . 0.0 109.775 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 13.4 p . . . . . 0 N--CA 1.454 -0.259 0 CA-C-O 120.809 0.338 . . . . 0.0 110.589 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -114.79 140.86 33.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.203 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.417 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.4 OUTLIER -86.11 139.11 31.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.098 -179.865 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.547 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.0 mm -111.36 117.2 49.83 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.362 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -71.24 129.68 16.4 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.321 2.014 . . . . 0.0 112.428 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.07 137.07 21.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.406 HG12 HG13 ' A' ' 13' ' ' VAL . 67.6 t -101.15 112.95 35.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.56 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.0 mt-10 -94.98 107.88 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.418 0.628 . . . . 0.0 110.754 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.406 HG13 HG12 ' A' ' 11' ' ' VAL . 2.7 m -127.84 -173.27 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.631 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.47 -33.57 36.57 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -175.46 175.78 2.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.741 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.453 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.9 mm? -78.17 140.66 61.6 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-O 120.772 0.32 . . . . 0.0 110.844 -177.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.97 173.65 9.95 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.81 2.34 . . . . 0.0 111.738 174.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -56.82 139.4 51.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.014 0.435 . . . . 0.0 110.952 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.04 -22.48 23.14 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.647 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.422 ' HB2' ' HB3' ' A' ' 16' ' ' LEU . 66.7 m-85 -93.7 166.55 12.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.441 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -124.9 99.49 6.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.386 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.521 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 57.9 ttp85 . . . . . 0 C--N 1.321 -0.66 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.681 -178.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.411 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 35.0 tt0 . . . . . 0 N--CA 1.45 -0.431 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.481 ' HB2' HD21 ' B' ' 81' ' ' LEU . 68.0 m-85 -87.19 153.88 21.16 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.417 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -132.87 116.59 16.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.558 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.7 p -102.27 132.3 48.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.01 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.61 151.35 44.94 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.701 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.0 OUTLIER -128.55 137.46 51.75 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -177.323 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.418 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 2.5 tmtp? -143.68 132.37 22.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.611 0.244 . . . . 0.0 110.413 -174.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.418 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.3 OUTLIER -95.65 141.4 29.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.335 -177.018 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -121.13 147.12 46.01 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -119.43 118.54 31.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.941 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.23 51.77 46.81 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.562 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.9 171.7 13.58 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.57 -16.95 62.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.251 0.548 . . . . 0.0 110.74 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.614 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -133.53 144.18 49.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.916 176.912 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.512 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.7 mppt? -98.87 -23.53 15.32 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -178.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.701 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -137.63 134.94 36.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.222 -179.125 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -120.18 117.89 29.07 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -111.91 130.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.558 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.1 mm? -112.62 112.85 24.68 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.375 -176.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.16 103.38 14.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.527 ' HB3' HG23 ' B' ' 106' ' ' THR . 10.3 pt-20 -113.28 150.31 32.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.026 0.441 . . . . 0.0 110.68 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -94.93 113.7 25.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.021 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 ptmm? -137.26 93.03 2.77 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.492 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' ALA . . . . . 0.411 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.577 175.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 120.694 0.283 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 p -133.45 78.74 62.14 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.459 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 86.3 Cg_endo -83.81 152.93 13.12 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.679 2.253 . . . . 0.0 112.158 179.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 67' ' ' SER . . . . . 0.491 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.9 m -156.03 141.63 17.8 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.184 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.433 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 51.0 t80 -99.52 129.41 45.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.326 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.577 HD21 ' HB2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -108.28 131.09 55.07 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.562 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -79.02 -24.28 43.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.332 -178.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.417 ' HB3' ' OD1' ' B' ' 69' ' ' ASN . . . -62.96 -51.71 65.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.476 . . . . 0.0 110.988 -176.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.577 ' HB2' HD21 ' B' ' 69' ' ' ASN . 3.6 mt-10 -104.86 -2.34 24.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.284 178.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 58.94 39.62 23.47 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.171 0.986 . . . . 0.0 110.229 174.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.577 HG13 ' O ' ' B' ' 72' ' ' GLU . 86.2 mt -118.67 136.3 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 114.447 -1.252 . . . . 0.0 111.131 -177.001 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.405 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.9 tm? -100.1 100.52 11.39 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.491 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -87.68 141.18 28.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.587 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.8 mm -90.94 -49.64 13.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.89 -175.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.2 m-20 -157.92 -170.54 3.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.39 21.19 5.35 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.398 178.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -107.07 -47.17 3.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.31 0.576 . . . . 0.0 110.038 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -151.1 153.08 34.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.296 -178.843 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 24.1 p -126.97 145.51 50.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.951 178.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.5 102.75 39.43 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-O 120.817 0.341 . . . . 0.0 110.66 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.464 ' HA ' HG12 ' B' ' 74' ' ' ILE . 74.1 Cg_endo -78.74 134.59 12.21 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.157 1.905 . . . . 0.0 112.3 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -98.49 153.27 38.06 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.464 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.436 ' HG2' HD12 ' B' ' 89' ' ' ILE . 37.1 Cg_endo -66.59 140.61 57.48 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.488 2.126 . . . . 0.0 111.322 175.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.61 -8.66 57.33 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.211 -176.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.75 -13.35 59.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.282 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.436 HD12 ' HG2' ' B' ' 86' ' ' PRO . 57.7 mt -114.15 135.15 54.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.895 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 90.7 t -86.79 114.47 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' VAL . . . . . 0.433 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.0 p -123.44 134.85 65.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.329 0.585 . . . . 0.0 111.325 -175.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.06 166.43 24.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.546 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.6 -12.26 60.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.749 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.63 -9.87 48.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.37 0.605 . . . . 0.0 110.637 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -111.39 -24.1 10.39 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.766 -178.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.406 HG22 HG13 ' B' ' 98' ' ' ILE . 82.4 mt -73.73 120.1 22.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.284 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.452 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -113.82 103.05 10.81 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.69 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.547 HD12 ' HB ' ' A' ' 8' ' ' ILE . 37.5 mt -105.75 120.98 57.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.98 0.419 . . . . 0.0 111.439 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -132.85 121.25 22.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.472 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.56 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 15.5 t-80 -105.24 117.9 35.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.42 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.702 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.3 mp -91.49 125.34 44.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 102' ' ' ARG . . . . . 0.445 ' HD3' ' OE2' ' A' ' 12' ' ' GLU . 12.1 mmm180 -76.22 -42.61 45.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.465 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 103' ' ' LYS . . . . . 0.417 ' HE3' ' HB2' ' B' ' 103' ' ' LYS . 36.0 ttmt -59.53 -47.82 84.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.681 -175.402 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.702 ' H ' HG22 ' B' ' 101' ' ' ILE . 16.0 mm-40 -87.47 -3.94 59.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.859 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 53.54 38.97 29.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.858 -175.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.527 HG23 ' HB3' ' B' ' 53' ' ' GLU . 59.6 m -125.92 137.87 53.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.93 0.395 . . . . 0.0 111.097 -172.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 107' ' ' LEU . . . . . 0.487 HD13 ' HB2' ' B' ' 100' ' ' HIS . 27.5 tp -109.23 119.72 40.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.181 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.564 ' CE1' HD13 ' B' ' 101' ' ' ILE . 47.4 m-85 -102.11 129.16 48.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.2 mm -115.39 118.43 58.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.808 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.7 m-85 -117.18 125.7 51.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.614 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.2 mt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.655 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.444 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 33.1 p . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 110.064 -0.346 . . . . 0.0 110.064 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -117.45 143.01 29.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.752 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.442 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -87.82 137.47 32.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.308 -178.074 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.451 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.3 mm -109.78 114.94 56.12 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.31 128.69 14.01 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.292 1.995 . . . . 0.0 112.269 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.52 132.67 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.111 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.467 HG12 HG13 ' A' ' 13' ' ' VAL . 79.4 t -94.72 114.55 31.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 174.365 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.487 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 23.0 mt-10 -91.1 111.2 22.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.549 0.69 . . . . 0.0 110.811 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.467 HG13 HG12 ' A' ' 11' ' ' VAL . 2.6 m -127.55 179.26 3.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.513 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -89.84 -28.05 19.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.147 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -169.64 164.14 10.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.977 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.516 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -78.92 143.72 62.47 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 120.692 0.282 . . . . 0.0 110.331 -178.351 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -71.35 175.04 9.92 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.917 2.412 . . . . 0.0 112.44 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.94 138.57 11.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.707 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.1 -5.09 61.09 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.166 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -106.49 149.23 27.3 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.172 0.51 . . . . 0.0 111.653 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -110.68 98.09 7.34 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.245 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.516 ' HD2' HD22 ' A' ' 16' ' ' LEU . 10.0 ttt180 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.181 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 . . . . . 0 N--CA 1.442 -0.848 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.461 ' HB2' HD21 ' B' ' 81' ' ' LEU . 81.3 m-85 -87.06 137.77 32.06 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.498 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.522 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 36.1 tt0 -110.19 113.7 26.59 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.04 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 96.8 t -93.98 124.06 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.917 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -118.58 131.76 56.2 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.22 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.652 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -118.91 135.78 54.4 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -176.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.492 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 5.3 tmtm? -142.57 131.65 23.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.869 0.366 . . . . 0.0 110.775 -173.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.492 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -90.5 132.04 35.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.927 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -116.69 149.01 40.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.904 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -132.29 122.62 25.42 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.547 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.03 23.85 58.65 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.307 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -113.28 170.8 7.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.79 -11.01 60.53 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 177.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.59 142.05 43.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.568 177.102 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.493 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.29 -19.69 18.38 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.148 0.499 . . . . 0.0 109.752 -175.293 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.652 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -135.83 132.76 37.06 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.65 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -115.93 122.02 44.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.202 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.607 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -121.41 128.95 75.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.555 HD11 ' CD2' ' B' ' 108' ' ' TYR . 3.7 mm? -114.83 120.61 40.6 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -122.12 103.56 13.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -113.06 153.49 28.05 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.147 0.499 . . . . 0.0 110.312 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -99.51 111.33 23.7 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.343 -176.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' B' ' 55' ' ' LYS . 7.6 ptmm? -134.7 92.19 2.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.182 0.515 . . . . 0.0 110.837 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.666 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.276 176.046 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.14 0.495 . . . . 0.0 110.539 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.4 t -134.66 79.63 52.58 Favored Pre-proline 0 C--N 1.317 -0.812 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.039 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.08 158.18 13.36 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.813 2.342 . . . . 0.0 112.019 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.3 m -158.1 144.57 17.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.038 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.437 ' HB2' HD23 ' B' ' 75' ' ' LEU . 72.2 t80 -104.34 128.95 52.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.358 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.476 ' OD1' ' HB3' ' B' ' 71' ' ' ALA . 0.1 OUTLIER -109.69 125.33 52.52 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.632 178.311 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -75.72 -24.82 56.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.444 -175.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' ALA . . . . . 0.476 ' HB3' ' OD1' ' B' ' 69' ' ' ASN . . . -62.28 -42.0 98.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.492 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.524 ' O ' HD13 ' B' ' 74' ' ' ILE . 12.6 mt-10 -112.96 -7.81 13.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.291 178.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 60.52 42.35 14.36 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 124.644 1.215 . . . . 0.0 110.38 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.524 HD13 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.67 138.51 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.008 178.266 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.8 tm? -106.33 99.86 9.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.12 144.66 27.4 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.7 mm -105.25 -49.37 9.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.076 0.465 . . . . 0.0 111.193 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.65 174.31 11.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -175.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.82 4.75 28.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.437 -0.887 . . . . 0.0 111.255 174.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 30.2 mttp -101.43 -34.57 9.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.906 -0.647 . . . . 0.0 110.424 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.5 OUTLIER -157.62 152.51 25.48 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.56 0.695 . . . . 0.0 111.989 -177.173 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 28.4 p -133.3 143.61 49.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.805 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.5 mm -101.76 106.48 47.1 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.475 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.497 ' HA ' HD12 ' B' ' 74' ' ' ILE . 73.4 Cg_endo -82.1 135.12 8.42 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.135 1.89 . . . . 0.0 112.343 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.59 149.05 35.54 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.55 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.425 ' HG2' HD12 ' B' ' 89' ' ' ILE . 32.5 Cg_endo -68.34 142.47 54.88 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.148 1.899 . . . . 0.0 111.337 175.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.462 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 8.9 mpt_? -78.74 -0.06 28.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.682 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -81.78 -15.61 53.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.043 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.425 HD12 ' HG2' ' B' ' 86' ' ' PRO . 51.5 mt -109.98 134.12 53.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.979 -176.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.96 114.38 25.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.64 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 51.4 t -120.6 135.5 60.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.303 0.573 . . . . 0.0 111.246 -173.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.07 161.15 38.54 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.708 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.72 64.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.799 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.62 -16.03 49.91 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.061 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -104.05 -22.21 13.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.603 0.715 . . . . 0.0 109.706 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.2 mt -73.99 119.28 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.276 178.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -113.14 108.86 17.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.856 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.451 HD12 ' HB ' ' A' ' 8' ' ' ILE . 55.5 mt -113.33 119.5 60.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.885 0.374 . . . . 0.0 111.296 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -128.56 117.7 21.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -178.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.487 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 32.3 t-80 -100.08 121.18 41.0 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.687 HG22 ' H ' ' B' ' 104' ' ' GLU . 70.5 mt -102.84 104.84 17.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 173.021 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -79.05 -18.05 54.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.186 -176.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.93 -44.33 85.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.424 0.631 . . . . 0.0 109.995 174.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.687 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.8 tp10 -94.24 -4.42 48.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.083 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 57.1 35.1 25.88 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.738 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.416 HG23 ' HB3' ' B' ' 53' ' ' GLU . 61.4 m -126.65 137.3 53.28 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.851 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.4 tp -106.52 125.31 50.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.277 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.603 ' CE1' HD12 ' B' ' 101' ' ' ILE . 21.6 m-85 -105.82 126.14 51.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.835 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.607 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.0 mm -116.48 124.92 73.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.027 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.415 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.2 m-85 -126.63 126.79 44.17 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.527 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.5 mt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.006 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 p . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.3 m -112.39 142.81 23.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.91 0.386 . . . . 0.0 110.875 -176.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.419 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -86.82 137.66 32.23 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.24 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.0 mm -109.11 121.79 41.74 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.874 -0.331 . . . . 0.0 110.272 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.2 127.83 14.78 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.368 2.045 . . . . 0.0 112.226 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.458 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -101.94 130.94 50.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.449 HG12 HG13 ' A' ' 13' ' ' VAL . 50.7 t -97.35 121.65 48.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.923 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.531 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 44.4 mt-10 -95.49 106.28 18.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.186 0.517 . . . . 0.0 110.799 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.535 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 3.6 m -128.79 -175.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.979 -177.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -99.46 -23.07 15.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.248 0.547 . . . . 0.0 109.879 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.73 156.3 36.11 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.87 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.91 146.09 48.25 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -69.24 173.66 10.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.553 2.168 . . . . 0.0 112.15 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -52.02 140.09 21.22 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.966 -177.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.34 -20.32 42.9 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.057 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -89.79 147.37 23.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.07 0.462 . . . . 0.0 111.509 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -108.02 106.47 16.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.477 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 . . . . . 0 C--N 1.324 -0.514 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.501 177.619 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.411 ' N ' ' HB2' ' B' ' 56' ' ' ALA . 33.9 tt0 . . . . . 0 N--CA 1.445 -0.716 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.509 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 84.7 m-85 -81.87 148.36 28.84 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -124.35 115.32 20.81 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.595 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.6 p -102.41 134.86 41.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.94 -173.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.426 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -126.19 147.23 49.69 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.182 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.618 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -121.85 135.88 54.91 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.618 -178.464 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.506 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 4.9 tmtm? -137.05 131.94 33.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.336 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.423 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.6 OUTLIER -95.23 137.23 34.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.857 0.36 . . . . 0.0 111.101 -179.504 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.506 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 39.5 m-85 -119.62 160.5 22.37 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.733 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -143.08 121.55 12.41 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 76.8 29.58 57.24 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.447 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.03 171.73 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.44 -12.77 55.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.172 0.511 . . . . 0.0 110.485 177.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.539 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -137.75 146.55 43.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.862 177.837 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.502 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.58 -21.52 15.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.247 0.546 . . . . 0.0 109.609 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.618 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.03 136.99 38.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.352 -178.885 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -124.38 121.6 35.38 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.599 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -113.73 129.86 68.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.595 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 4.4 mm? -112.36 115.09 28.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.136 -177.382 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.0 103.56 14.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -109.48 153.31 24.24 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.475 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -94.74 114.44 26.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.994 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -137.94 92.18 2.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.282 0.563 . . . . 0.0 110.89 176.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' ALA . . . . . 0.411 ' HB2' ' N ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.321 -0.631 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 174.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 14.7 m -129.25 78.35 76.11 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 0.0 109.781 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 61.0 Cg_endo -81.45 145.37 14.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.317 2.011 . . . . 0.0 112.136 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 67' ' ' SER . . . . . 0.562 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.5 m -155.38 144.11 20.56 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.246 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.404 ' HE2' ' CD2' ' B' ' 70' ' ' PHE . 65.2 t80 -105.3 120.37 41.4 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.52 -177.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -99.74 114.95 28.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.424 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.404 ' CD2' ' HE2' ' B' ' 68' ' ' TYR . 85.1 m-85 -63.88 -32.12 73.53 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.42 -176.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.27 -41.81 69.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.973 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.534 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.98 1.79 15.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.623 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.73 45.55 21.76 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.363 1.039 . . . . 0.0 111.32 -175.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.534 HG13 ' O ' ' B' ' 72' ' ' GLU . 72.3 mt -123.26 137.62 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.135 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -105.8 107.05 17.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.564 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 10.8 p90 -95.36 144.82 25.59 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.165 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 49.3 mm -91.8 -40.77 12.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.721 -175.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.9 m-20 -161.16 -175.96 5.17 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.48 7.31 40.17 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.586 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.46 -37.99 11.15 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.074 0.464 . . . . 0.0 110.21 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.485 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -159.26 153.01 22.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.944 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 10.1 p -128.16 141.62 51.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.642 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 45.5 mm -104.69 105.62 51.34 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.852 0.358 . . . . 0.0 110.673 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.442 ' HA ' HG12 ' B' ' 74' ' ' ILE . 73.6 Cg_endo -80.9 134.51 9.55 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.188 1.925 . . . . 0.0 112.632 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.48 143.84 27.17 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.76 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -67.27 142.2 59.63 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.133 1.889 . . . . 0.0 111.306 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -71.26 -5.01 28.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.125 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -75.31 -17.07 60.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.45 0.643 . . . . 0.0 109.709 178.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 53.5 mt -113.7 137.71 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.764 -176.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 60.6 t -90.64 113.9 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 2.3 p -124.53 134.57 66.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.155 0.502 . . . . 0.0 111.185 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.05 167.32 22.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.302 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.58 -23.68 64.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 111.556 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.89 -9.8 58.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.033 -177.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -113.89 -21.1 10.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.021 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 79.5 mt -75.33 117.97 20.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.354 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.418 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 10.8 mmmm -113.07 107.83 16.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.68 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.458 HG22 HG23 ' A' ' 10' ' ' VAL . 46.7 mt -110.38 120.77 61.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 0.0 111.518 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -133.23 119.52 19.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.614 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 16.9 t-80 -101.82 113.89 27.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.628 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.649 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.4 mt -89.93 108.43 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -69.2 -40.65 77.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.716 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -58.6 -47.44 84.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.108 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.649 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.3 tp10 -87.06 -3.19 59.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.191 -176.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 59.3 27.85 17.02 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.726 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 35.0 m -124.43 134.42 53.08 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.116 0.484 . . . . 0.0 111.231 -171.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 107' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' B' ' 100' ' ' HIS . 37.5 tp -103.6 123.13 46.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.098 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.588 ' CE1' HD12 ' B' ' 101' ' ' ILE . 14.8 m-85 -103.83 124.43 48.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.894 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.599 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.9 mm -112.23 120.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.619 175.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.494 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.3 m-85 -118.63 125.87 50.7 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 71.7 mt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.642 -0.694 . . . . 0.0 109.986 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.454 -0.271 0 CA-C-O 120.901 0.381 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.479 HG21 ' HB2' ' B' ' 93' ' ' ALA . 27.6 m -134.09 164.32 34.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.349 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.03 153.75 24.18 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.446 ' HB ' HD12 ' B' ' 98' ' ' ILE . 5.2 mm -118.74 128.24 26.08 Favored Pre-proline 0 C--N 1.307 -1.25 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.413 -174.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.98 135.07 24.63 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.452 2.102 . . . . 0.0 111.939 177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.493 HG23 HG22 ' B' ' 98' ' ' ILE . 2.6 p -113.64 130.81 67.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.173 0.511 . . . . 0.0 110.566 178.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.76 HG12 ' HA ' ' B' ' 99' ' ' PHE . 4.0 p -86.22 149.03 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.512 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.581 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 34.6 mt-10 -115.81 94.46 4.69 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.595 0.712 . . . . 0.0 110.225 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.429 HG13 HG22 ' A' ' 11' ' ' VAL . 10.2 m -114.16 179.72 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.492 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -95.62 -24.9 16.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.365 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -168.36 163.0 12.78 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.415 176.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.4 mt -83.48 154.02 65.57 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-O 121.066 0.46 . . . . 0.0 111.674 -175.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 165.93 31.13 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.894 2.396 . . . . 0.0 111.428 176.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.413 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -61.54 136.36 57.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.341 -179.142 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -4.75 29.99 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.817 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -111.13 139.01 46.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.376 0.608 . . . . 0.0 111.856 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -93.74 94.69 8.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.81 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.621 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 31.6 ttp85 . . . . . 0 C--N 1.322 -0.607 0 CA-C-O 121.27 0.557 . . . . 0.0 111.54 -175.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 . . . . . 0 N--CA 1.445 -0.717 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.504 ' HB2' HD21 ' B' ' 81' ' ' LEU . 85.8 m-85 -86.04 157.68 20.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.497 -177.085 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.425 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 36.8 tt0 -131.51 119.18 21.19 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 171.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.79 136.32 27.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.466 -175.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.447 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -130.88 146.41 52.3 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 176.652 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.613 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.6 OUTLIER -124.75 136.64 54.04 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -177.332 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.479 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.1 tmtp? -136.58 129.49 30.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.742 0.306 . . . . 0.0 110.185 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.474 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 6.7 mpt_? -97.11 134.3 40.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.023 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.479 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.0 m-85 -114.2 164.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.454 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -144.35 119.23 9.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.784 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.72 43.79 93.56 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.804 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -124.56 171.35 10.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -19.24 65.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.293 0.568 . . . . 0.0 110.688 178.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.504 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.04 136.36 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.228 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.511 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -87.68 -25.1 23.66 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.09 0.472 . . . . 0.0 110.041 -173.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.613 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.17 138.9 35.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.642 -178.215 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -122.97 119.9 31.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.709 175.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.584 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.0 mp -113.64 128.06 70.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.4 mm? -110.68 117.46 33.53 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.082 -178.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -124.06 103.99 13.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.509 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.6 pt-20 -108.36 149.28 28.91 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.484 -178.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -96.62 113.0 24.53 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.768 -177.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -133.51 93.95 3.23 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.508 0.67 . . . . 0.0 110.74 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.807 -179.709 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.2 m -137.41 80.18 33.99 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-O 120.917 0.389 . . . . 0.0 110.096 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.95 150.02 23.17 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.587 2.192 . . . . 0.0 111.948 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 9.6 m -154.65 150.05 27.25 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.426 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.498 ' HB2' HD23 ' B' ' 75' ' ' LEU . 61.9 t80 -115.08 124.43 51.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.365 0.603 . . . . 0.0 111.19 -176.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -105.03 113.43 27.02 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.389 174.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' PHE . . . . . 0.403 ' CD2' ' HE2' ' B' ' 68' ' ' TYR . 88.1 m-85 -63.9 -32.82 74.48 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.907 -176.038 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.73 70.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.727 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.511 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -109.9 2.98 20.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.208 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.83 44.7 18.31 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.477 1.11 . . . . 0.0 111.36 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.511 HG13 ' O ' ' B' ' 72' ' ' GLU . 61.6 mt -121.49 134.16 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.484 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.498 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -101.95 107.09 18.13 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 176.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.38 140.61 29.41 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 41.2 mm -91.63 -59.62 2.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.051 0.453 . . . . 0.0 110.655 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -149.68 -179.48 7.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.326 -178.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.12 6.44 7.1 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.244 177.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -94.43 -43.41 8.38 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.506 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.6 pp -157.82 153.72 26.89 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.708 -177.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 41.3 t -130.12 149.06 51.99 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.683 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.1 mm -112.6 105.77 55.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.897 0.38 . . . . 0.0 111.104 -174.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -79.04 136.86 13.3 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.352 2.034 . . . . 0.0 112.416 177.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.46 156.08 35.6 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.284 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.456 ' HG2' HD12 ' B' ' 89' ' ' ILE . 31.9 Cg_endo -64.92 141.06 69.29 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.31 2.007 . . . . 0.0 111.492 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.525 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 8.4 mpt_? -80.1 1.81 26.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.778 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.5 -20.28 28.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.286 0.565 . . . . 0.0 109.974 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.456 HD12 ' HG2' ' B' ' 86' ' ' PRO . 62.2 mt -103.99 134.61 44.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.601 -174.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.6 t -84.17 110.13 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.696 177.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 45.2 t -111.78 132.56 60.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.499 -175.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.463 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.78 161.15 38.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.78 178.757 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.479 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.29 -18.0 63.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.699 -176.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.65 -12.36 54.08 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.463 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 21.9 t70 -110.99 -24.04 10.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.097 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.407 HG22 HG13 ' B' ' 98' ' ' ILE . 84.6 mt -71.42 113.43 7.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.197 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.447 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.5 mmmt -109.54 105.7 15.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.93 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.493 HG22 HG23 ' A' ' 10' ' ' VAL . 57.0 mt -109.73 121.87 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.073 0.463 . . . . 0.0 111.69 -177.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.76 ' HA ' HG12 ' A' ' 11' ' ' VAL . 88.3 m-85 -129.07 118.41 22.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.627 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.581 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 19.9 t-80 -99.39 106.66 18.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.097 0.475 . . . . 0.0 109.859 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.61 HD12 ' CE1' ' B' ' 108' ' ' TYR . 70.4 mt -87.24 115.24 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.698 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 102' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 102' ' ' ARG . 33.2 mtp85 -77.25 -19.31 56.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.399 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -57.63 -48.56 79.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.767 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.51 ' H ' HG22 ' B' ' 101' ' ' ILE . 63.1 mm-40 -106.85 0.28 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.707 -179.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 54.07 40.54 31.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.83 -172.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.509 HG23 ' HB3' ' B' ' 53' ' ' GLU . 50.7 m -119.65 137.35 53.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.815 -174.257 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.75 119.6 39.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.424 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.621 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 24.5 m-85 -101.81 123.01 45.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.732 178.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.56 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.9 mm -113.19 119.44 60.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.947 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.447 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 88.8 m-85 -118.84 128.69 54.69 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.504 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.2 mt . . . . . 0 C--O 1.243 0.754 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.352 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.0 p . . . . . 0 N--CA 1.45 -0.462 0 CA-C-O 121.186 0.517 . . . . 0.0 111.592 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -128.53 144.19 38.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.669 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.76 137.33 33.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.904 0.383 . . . . 0.0 110.004 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.417 ' HB ' HD12 ' B' ' 98' ' ' ILE . 10.4 mm -108.05 120.31 47.29 Favored Pre-proline 0 C--N 1.316 -0.849 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.13 127.7 16.37 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.23 1.953 . . . . 0.0 112.178 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.488 HG23 HG22 ' B' ' 98' ' ' ILE . 2.2 p -102.46 127.12 56.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.535 HG12 HG13 ' A' ' 13' ' ' VAL . 47.8 t -95.02 125.73 47.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.056 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.462 ' OE1' ' HD2' ' B' ' 102' ' ' ARG . 44.3 mt-10 -90.55 107.04 18.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.215 0.531 . . . . 0.0 110.253 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.672 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 11.0 m -126.63 177.4 5.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.357 -179.221 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -98.64 -16.97 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.008 0.432 . . . . 0.0 110.03 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -170.52 159.1 6.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.574 178.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.456 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.5 mm? -76.83 150.72 81.77 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.08 172.83 13.14 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.272 1.981 . . . . 0.0 111.634 174.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.52 139.51 58.23 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.139 0.495 . . . . 0.0 111.004 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.83 -15.0 37.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.132 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -95.35 166.71 11.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.89 0.376 . . . . 0.0 111.427 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -123.41 96.25 4.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.46 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.456 ' HB2' HD23 ' A' ' 16' ' ' LEU . 22.5 ttp85 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.125 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.485 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 39.0 tt0 . . . . . 0 N--CA 1.446 -0.652 0 CA-C-O 121.435 0.636 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -83.82 157.2 22.13 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.014 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -133.12 119.59 20.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.009 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.6 t -96.09 133.52 37.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.888 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.467 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.02 120.58 27.79 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.04 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.582 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.2 ttt -105.09 145.93 29.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.497 0.189 . . . . 0.0 110.614 -174.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.445 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.48 132.89 18.59 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -176.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.445 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.59 136.41 36.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.101 0.477 . . . . 0.0 110.86 179.702 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -117.57 167.65 11.12 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.363 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -156.59 109.43 2.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.938 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.4 11.85 46.85 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.305 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -111.69 171.59 7.4 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.15 -24.77 63.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.354 0.597 . . . . 0.0 110.706 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.652 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.4 p90 -124.42 142.75 51.06 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.859 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -102.04 -18.55 15.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.98 -175.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.624 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -140.23 132.93 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.823 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -119.67 120.32 36.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 177.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.624 HD11 HD12 ' B' ' 48' ' ' LEU . 2.0 mp -118.05 129.21 74.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.497 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.03 114.58 26.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.188 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.43 103.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -110.33 152.92 25.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.262 0.554 . . . . 0.0 111.118 -176.063 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 32.7 t-20 -94.6 113.35 25.15 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.053 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -137.94 91.48 2.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.171 0.51 . . . . 0.0 110.467 176.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' ALA . . . . . 0.485 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.016 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.7 m -137.09 79.23 38.39 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-O 121.164 0.507 . . . . 0.0 109.829 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -76.27 153.0 35.55 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.865 2.377 . . . . 0.0 112.668 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.9 m -153.91 147.33 24.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.138 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -103.92 120.73 41.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.304 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.446 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.8 p30 -100.2 112.38 24.7 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.386 176.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -63.1 -33.21 74.95 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.595 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.13 77.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.875 -175.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.487 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -112.45 3.4 16.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.257 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 8.9 p30 47.05 45.77 15.85 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.38 1.072 . . . . 0.0 111.616 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.494 HG12 ' HA ' ' B' ' 84' ' ' PRO . 63.7 mt -121.4 139.29 48.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.065 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -102.22 102.54 12.96 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.0 140.88 29.42 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -177.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -94.75 -54.43 7.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.469 -177.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -149.64 178.79 8.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.49 6.6 15.87 Favored Glycine 0 CA--C 1.517 0.184 0 C-N-CA 120.659 -0.781 . . . . 0.0 111.939 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -96.21 -37.3 10.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.49 . . . . 0.0 110.066 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.427 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -158.01 151.92 24.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 112.094 178.618 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.0 p -128.78 148.72 50.88 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.67 177.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.418 HG21 HG12 ' B' ' 50' ' ' ILE . 49.5 mm -105.86 104.25 48.09 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.896 0.379 . . . . 0.0 110.391 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.494 ' HA ' HG12 ' B' ' 74' ' ' ILE . 61.4 Cg_endo -75.48 131.76 14.1 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.245 1.963 . . . . 0.0 112.211 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 54.0 mt -101.32 146.5 32.3 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.237 -175.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.437 ' HG2' HD12 ' B' ' 89' ' ' ILE . 33.0 Cg_endo -66.65 142.85 65.82 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.276 1.984 . . . . 0.0 111.4 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.434 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 9.2 mpt_? -78.24 1.01 22.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.533 -175.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -93.28 -1.4 56.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.579 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.437 HD12 ' HG2' ' B' ' 86' ' ' PRO . 60.0 mt -116.73 137.92 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 67.1 t -87.03 113.02 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 1.6 p -125.27 132.49 71.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.311 0.577 . . . . 0.0 111.393 -174.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.37 163.64 32.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.028 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.23 63.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.67 -13.4 51.59 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -111.28 -21.19 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.111 -175.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.41 HG22 HG21 ' A' ' 8' ' ' ILE . 82.0 mt -75.73 118.56 22.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.169 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.47 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.1 mmmt -111.98 107.72 16.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.114 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.488 HG22 HG23 ' A' ' 10' ' ' VAL . 53.4 mt -111.42 121.43 63.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.983 0.421 . . . . 0.0 111.364 -178.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -132.66 122.53 24.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.205 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.433 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 45.3 t60 -102.86 110.7 22.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.998 0.428 . . . . 0.0 110.752 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.761 HG22 ' H ' ' B' ' 104' ' ' GLU . 56.1 mt -91.16 114.18 28.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.195 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 102' ' ' ARG . . . . . 0.462 ' HD2' ' OE1' ' A' ' 12' ' ' GLU . 39.5 mtp85 -81.06 -26.09 36.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.126 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.4 tttp -58.55 -42.31 87.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.337 177.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.761 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.6 tp10 -105.29 1.7 28.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.306 0.574 . . . . 0.0 110.002 -177.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 55.47 31.47 17.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.903 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 37.2 m -123.49 139.95 53.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 121.015 0.436 . . . . 0.0 110.939 -173.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.53 121.32 44.05 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.799 178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.637 ' CE1' HD12 ' B' ' 101' ' ' ILE . 8.4 m-85 -100.42 126.36 46.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.245 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.57 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 39.0 mm -115.94 117.73 56.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.732 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.47 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 87.3 m-85 -119.01 123.04 43.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.652 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 68.1 mt . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.745 -0.645 . . . . 0.0 109.807 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 39.2 p . . . . . 0 N--CA 1.446 -0.667 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.466 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.0 m -120.66 140.1 45.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.013 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.435 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -86.54 139.45 30.84 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.768 -179.223 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.448 ' HB ' HD12 ' B' ' 98' ' ' ILE . 5.1 mm -112.13 119.6 43.67 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -70.54 128.73 15.71 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.236 1.957 . . . . 0.0 112.105 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG13 HG22 ' B' ' 98' ' ' ILE . 48.0 t -83.58 135.45 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.135 178.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.581 HG12 HG13 ' A' ' 13' ' ' VAL . 38.6 t -99.18 111.07 27.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.506 ' OE1' ' HD3' ' B' ' 102' ' ' ARG . 45.1 mt-10 -85.9 102.21 13.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 0.0 110.605 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.581 HG13 HG12 ' A' ' 11' ' ' VAL . 5.8 m -123.16 -176.46 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.072 -178.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -94.43 -29.96 14.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -162.61 162.93 27.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.534 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.458 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -81.72 143.45 50.61 Favored Pre-proline 0 N--CA 1.448 -0.539 0 CA-C-O 120.776 0.322 . . . . 0.0 110.817 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -51.62 171.0 0.16 Allowed 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 123.931 3.087 . . . . 0.0 113.469 174.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -65.59 141.13 58.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.494 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.48 -4.6 60.09 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.493 -0.861 . . . . 0.0 111.22 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.71 164.76 11.72 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.48 94.36 4.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.042 0.449 . . . . 0.0 111.563 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.458 ' HB2' HD23 ' A' ' 16' ' ' LEU . 13.4 ttp180 . . . . . 0 C--N 1.321 -0.65 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.8 m-85 -86.39 156.51 20.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.602 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.536 ' OE2' ' HE2' ' B' ' 37' ' ' LYS . 35.0 tt0 -129.24 118.64 22.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.506 -0.77 . . . . 0.0 108.983 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -94.29 133.88 33.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.412 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.536 ' HE2' ' OE2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -128.84 145.41 51.21 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.382 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -125.68 138.38 53.89 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.442 -178.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.598 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 6.6 tmtm? -142.13 135.12 28.74 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -173.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.443 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 7.7 mpt_? -99.07 133.33 43.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.813 0.339 . . . . 0.0 111.122 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.598 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 45.8 m-85 -118.44 150.79 38.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.619 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -134.39 120.94 20.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.642 177.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.36 26.49 51.54 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.578 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.22 171.81 8.03 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -20.53 65.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.335 0.588 . . . . 0.0 110.391 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.6 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -126.38 142.01 51.69 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.983 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.505 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.6 mppt? -101.81 -21.53 14.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.599 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.76 130.52 25.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.899 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -116.11 129.73 56.47 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.599 HD11 HD12 ' B' ' 48' ' ' LEU . 2.7 mp -122.06 130.64 74.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.542 HD11 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -116.47 123.59 47.86 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.277 -176.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.7 mp -125.61 103.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.545 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.1 pt-20 -108.38 153.6 23.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.949 0.404 . . . . 0.0 110.191 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -98.18 113.6 25.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.662 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -135.65 93.19 2.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.6 0.714 . . . . 0.0 110.318 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.48 -179.0 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 . . . . . 0 CA--C 1.516 -0.365 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.2 m -130.58 78.81 73.35 Favored Pre-proline 0 C--N 1.318 -0.769 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.208 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.458 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 94.8 Cg_endo -84.54 156.02 12.23 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.557 2.171 . . . . 0.0 112.492 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.8 p -162.11 139.67 8.56 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.112 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.446 ' HB2' HD23 ' B' ' 75' ' ' LEU . 60.7 t80 -104.34 128.05 52.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.436 -178.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.551 HD21 ' HB2' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -105.37 132.59 51.37 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.94 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -79.61 -25.74 41.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.499 -178.044 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.66 -51.11 66.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.143 0.496 . . . . 0.0 110.841 -175.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.551 ' HB2' HD21 ' B' ' 69' ' ' ASN . 2.4 mt-10 -104.68 -3.39 23.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.15 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 73' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 2.3 p-10 57.74 43.67 21.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.088 0.947 . . . . 0.0 110.909 173.671 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' B' ' 72' ' ' GLU . 62.4 mt -119.84 134.28 63.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.14 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.446 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.6 tm? -105.48 103.3 12.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.971 178.54 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -91.43 146.56 23.7 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.54 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 40.3 mm -99.01 -51.86 9.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.481 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.445 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.9 m-20 -155.67 179.48 9.15 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.31 33.92 1.12 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.381 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 80' ' ' LYS . . . . . 0.445 ' H ' ' C ' ' B' ' 78' ' ' ASN . 31.5 mmtp -124.12 -42.04 2.17 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.428 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.7 OUTLIER -155.23 153.39 30.58 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.802 -178.191 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 54.9 p -127.69 141.76 51.52 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.231 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -104.67 104.65 46.78 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-O 120.815 0.34 . . . . 0.0 110.63 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.05 132.9 8.65 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 122.213 1.942 . . . . 0.0 111.942 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -95.58 147.36 32.88 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.892 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.48 ' HG2' HD12 ' B' ' 89' ' ' ILE . 34.8 Cg_endo -66.11 139.02 54.15 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.188 1.926 . . . . 0.0 111.396 176.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.02 -5.13 39.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.553 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.89 -20.09 58.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.842 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.48 HD12 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -111.67 137.26 45.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.446 -176.323 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 6.4 p -88.57 122.71 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 47.5 t -122.55 136.09 60.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.58 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.54 164.15 30.99 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.763 176.889 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.466 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.04 -22.37 66.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.144 0.497 . . . . 0.0 111.197 -176.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -11.88 57.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.867 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.58 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 15.5 t70 -105.18 -25.06 12.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.511 -177.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.414 HG22 HG13 ' B' ' 98' ' ' ILE . 72.0 mt -75.66 119.13 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.433 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.408 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 11.6 mmmm -113.23 100.34 8.5 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.753 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.448 HD12 ' HB ' ' A' ' 8' ' ' ILE . 45.3 mt -104.44 118.43 51.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 121.026 0.441 . . . . 0.0 111.211 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -129.8 119.02 22.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.574 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.429 ' HB2' HD13 ' B' ' 107' ' ' LEU . 85.2 t60 -101.57 121.49 42.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.81 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.543 HG22 ' H ' ' B' ' 104' ' ' GLU . 76.9 mt -101.86 116.2 45.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.463 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 102' ' ' ARG . . . . . 0.506 ' HD3' ' OE1' ' A' ' 12' ' ' GLU . 21.4 mtm180 -81.2 -39.77 24.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.647 -174.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.41 -32.54 71.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.337 0.589 . . . . 0.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.543 ' H ' HG22 ' B' ' 101' ' ' ILE . 32.6 tt0 -101.36 -5.47 25.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.129 -178.241 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 34.5 mtm180 51.03 37.77 18.76 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.766 -1.107 . . . . 0.0 111.779 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.411 HG23 ' HB3' ' B' ' 53' ' ' GLU . 45.7 m -128.41 139.68 52.23 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.797 -175.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 107' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' B' ' 100' ' ' HIS . 52.5 tp -111.19 117.19 32.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.542 ' CE2' HD11 ' B' ' 51' ' ' LEU . 44.0 m-85 -98.62 124.5 43.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.322 -178.019 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.473 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 45.0 mm -113.11 117.01 54.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.108 178.146 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 72.8 m-85 -118.71 127.66 53.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 177.159 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.6 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 64.1 mt . . . . . 0 C--O 1.248 1.013 0 CA-C-O 119.035 -0.507 . . . . 0.0 109.778 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 21.2 p . . . . . 0 N--CA 1.448 -0.571 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.45 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.4 m -116.76 136.61 53.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.448 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.8 138.11 31.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -176.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.489 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.13 121.11 42.62 Favored Pre-proline 0 C--N 1.319 -0.751 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.351 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.91 135.54 23.54 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 122.58 2.187 . . . . 0.0 112.482 178.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.495 HG13 HG22 ' B' ' 98' ' ' ILE . 26.0 t -98.8 134.75 36.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.982 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.842 HG12 ' HA ' ' B' ' 99' ' ' PHE . 3.6 p -89.6 148.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.526 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -115.27 94.22 4.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.733 0.778 . . . . 0.0 110.237 170.256 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.429 HG13 HG22 ' A' ' 11' ' ' VAL . 5.1 m -115.43 -171.75 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.358 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.402 ' O ' HG12 ' B' ' 101' ' ' ILE . 6.4 m-20 -99.19 -30.75 12.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -153.82 178.05 10.33 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.406 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.45 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -84.6 149.36 54.18 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.393 173.974 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.442 ' HG2' ' CE1' ' A' ' 20' ' ' TYR . 39.7 Cg_endo -68.94 165.21 30.76 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.046 1.831 . . . . 0.0 111.472 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.05 135.41 56.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.097 0.475 . . . . 0.0 110.869 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.46 -5.27 29.77 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.815 -174.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' A' ' 17' ' ' PRO . 65.0 m-85 -106.35 176.8 5.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 0.0 111.318 177.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -131.54 97.35 4.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.538 -178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.591 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 64.3 ttp85 . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.501 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 N--CA 1.443 -0.801 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.502 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.9 m-85 -83.11 148.17 27.66 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.753 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -120.37 114.66 22.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.283 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 82.8 t -94.62 125.22 47.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.503 -178.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.487 ' HB2' ' HB2' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -123.23 142.49 50.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.204 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.577 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.5 OUTLIER -127.4 137.83 52.84 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 121.169 -0.212 . . . . 0.0 110.552 -174.504 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.504 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.5 tmtt? -145.58 132.9 20.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.653 0.263 . . . . 0.0 110.362 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.504 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -93.09 139.56 30.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.358 -177.835 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.432 ' CE2' ' HE1' ' B' ' 46' ' ' TYR . 23.9 m-85 -121.49 167.67 12.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.31 176.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -156.4 112.0 2.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.075 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 97.66 16.81 32.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.056 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.09 172.09 7.27 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.7 -18.91 63.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.114 0.483 . . . . 0.0 110.87 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.586 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 2.4 p90 -130.69 147.85 52.41 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.508 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.43 -20.07 14.19 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.203 0.525 . . . . 0.0 109.806 -177.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.577 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -136.23 133.52 37.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.498 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.7 ttp180 -115.83 115.6 26.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.405 176.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.597 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -114.64 131.86 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.572 HD11 ' CD2' ' B' ' 108' ' ' TYR . 4.2 mm? -115.23 122.91 47.44 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.989 -178.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.63 103.46 11.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 176.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.502 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.8 pt-20 -113.05 153.42 28.16 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.072 0.463 . . . . 0.0 110.477 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -96.37 110.05 22.46 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.885 -177.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -135.67 93.17 2.91 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.509 0.671 . . . . 0.0 110.775 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.26 -179.655 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 38.7 m -133.55 78.8 61.41 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-O 121.009 0.433 . . . . 0.0 110.104 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.592 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 93.2 Cg_endo -82.09 150.89 15.93 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.569 2.179 . . . . 0.0 112.193 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -158.33 144.71 17.31 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.125 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.463 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 45.2 t80 -102.71 118.3 36.54 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.615 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.423 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.9 OUTLIER -101.18 115.84 31.42 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.753 176.248 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -63.8 -26.26 68.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.619 -178.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.13 63.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.784 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.585 ' O ' HG13 ' B' ' 74' ' ' ILE . 11.2 mt-10 -112.08 2.44 16.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.16 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 8.2 p30 47.69 46.02 18.12 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.54 1.15 . . . . 0.0 110.811 -174.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.585 HG13 ' O ' ' B' ' 72' ' ' GLU . 84.7 mt -120.85 137.09 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.097 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.434 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.3 tm? -100.11 100.71 11.61 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 177.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.592 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -87.82 137.61 32.19 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.597 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.2 mm -89.79 -49.11 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.403 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -151.59 -177.57 6.18 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.55 0.96 54.03 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.238 -0.982 . . . . 0.0 111.918 176.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -94.25 -34.77 12.74 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.81 0.338 . . . . 0.0 110.411 -176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.4 OUTLIER -157.0 152.39 26.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.802 178.041 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' B' ' 84' ' ' PRO . 35.8 p -128.45 150.0 50.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.105 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -107.77 98.82 26.65 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-O 120.821 0.344 . . . . 0.0 110.553 -179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.541 ' HA ' HG12 ' B' ' 74' ' ' ILE . 14.5 Cg_exo -70.53 135.95 29.81 Favored 'Trans proline' 0 CA--C 1.515 -0.429 0 C-N-CA 122.558 2.172 . . . . 0.0 112.127 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.03 147.84 35.17 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.257 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.457 ' HG2' HD12 ' B' ' 89' ' ' ILE . 36.8 Cg_endo -66.96 139.27 50.8 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.251 1.967 . . . . 0.0 111.64 178.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -7.72 52.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.683 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -80.41 -13.74 58.89 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.636 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.457 HD12 ' HG2' ' B' ' 86' ' ' PRO . 61.1 mt -113.9 133.44 59.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.058 -174.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 8.8 p -83.94 125.57 40.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.464 176.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 91' ' ' VAL . . . . . 0.463 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.3 p -137.23 137.45 46.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 111.447 -174.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.487 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -139.73 165.62 26.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.618 177.926 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.45 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -59.54 -25.89 64.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.291 0.567 . . . . 0.0 111.237 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.95 -12.98 59.29 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.487 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 23.0 t0 -106.01 -22.57 12.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 0.0 109.639 -177.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 75.4 mt -76.39 117.11 20.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.9 mmmt -110.96 109.45 19.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.157 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.495 HG22 HG13 ' A' ' 10' ' ' VAL . 50.8 mt -113.48 118.01 57.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 121.206 0.526 . . . . 0.0 111.401 -178.127 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.842 ' HA ' HG12 ' A' ' 11' ' ' VAL . 73.7 m-85 -128.06 117.67 22.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.475 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.526 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 20.6 t-80 -98.96 110.08 22.74 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.027 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.673 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.7 mp -91.82 109.05 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -81.08 -17.74 49.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.593 -174.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -70.07 -47.61 61.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.14 0.495 . . . . 0.0 110.076 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.673 ' H ' HG22 ' B' ' 101' ' ' ILE . 18.5 mm-40 -86.71 -1.8 58.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.256 177.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 53.02 38.5 27.46 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.576 -176.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.416 HG23 ' HB3' ' B' ' 53' ' ' GLU . 40.1 m -125.88 128.12 47.09 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.099 0.476 . . . . 0.0 110.956 -173.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 107' ' ' LEU . . . . . 0.425 HD11 ' CG2' ' B' ' 98' ' ' ILE . 45.1 tp -98.9 112.57 24.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.907 177.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.591 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 61.2 m-85 -91.99 123.13 35.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.952 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.597 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.7 mm -112.12 124.9 69.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.961 177.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.496 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 87.8 m-85 -126.9 123.73 37.91 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.038 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.586 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.457 -0.783 . . . . 0.0 110.109 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 N--CA 1.451 -0.415 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.504 HG21 ' HB2' ' B' ' 93' ' ' ALA . 21.6 m -130.18 148.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.886 0.374 . . . . 0.0 110.569 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.484 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -92.3 138.96 31.08 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.6 mm -107.73 122.95 39.34 Favored Pre-proline 0 C--N 1.32 -0.677 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.467 -176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.11 129.02 15.55 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.293 1.995 . . . . 0.0 112.015 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.476 HG23 HG22 ' B' ' 98' ' ' ILE . 2.4 p -104.67 135.3 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.311 0.577 . . . . 0.0 110.869 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' B' ' 99' ' ' PHE . 3.5 p -86.53 148.8 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.632 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 44.2 mt-10 -115.23 93.75 4.43 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.565 0.698 . . . . 0.0 110.047 170.284 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 12.6 m -116.06 -173.44 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.938 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.54 -22.48 16.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.569 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -169.98 172.95 6.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.395 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -76.13 150.53 83.22 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.38 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 51.1 Cg_endo -71.64 172.91 13.42 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 121.948 1.765 . . . . 0.0 111.968 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -53.52 138.53 33.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.315 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.29 -9.61 53.89 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.64 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 60.7 m-85 -99.92 143.07 30.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 0.0 111.969 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -96.2 95.58 8.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.619 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.485 ' HB2' HD23 ' A' ' 16' ' ' LEU . 18.2 ttt180 . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.702 -175.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.431 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 36.8 tt0 . . . . . 0 N--CA 1.449 -0.524 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.481 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -87.56 153.64 21.24 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.496 176.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -125.89 118.18 24.91 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.77 126.87 48.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.869 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.58 119.12 26.29 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.665 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.2 ttt -101.85 139.64 37.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -144.98 131.65 19.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.769 0.319 . . . . 0.0 110.621 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -87.99 143.12 27.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.511 0.672 . . . . 0.0 112.586 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -131.17 152.48 50.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.074 176.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -140.97 116.3 10.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.292 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.98 16.95 58.72 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.148 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.27 172.06 7.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.758 0.313 . . . . 0.0 110.721 -177.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.02 -3.54 16.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.124 0.488 . . . . 0.0 110.864 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.461 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -147.42 140.21 24.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.523 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.1 mppt? -94.28 -23.29 17.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.268 0.556 . . . . 0.0 109.646 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.665 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -135.74 134.0 38.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.16 179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -116.54 123.01 46.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.476 174.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.0 mp -119.7 127.83 75.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.514 HD11 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -113.01 118.48 34.94 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -121.81 102.88 12.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 176.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.4 pt-20 -108.79 153.95 22.76 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.353 -178.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -97.67 115.34 27.75 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ptmm? -137.55 91.41 2.59 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.386 176.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 56' ' ' ALA . . . . . 0.431 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.562 172.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 49.9 m -134.9 78.96 53.02 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 64.3 Cg_endo -78.93 150.27 23.41 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.609 2.206 . . . . 0.0 112.255 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 11.4 m -155.86 147.47 22.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.384 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.46 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.0 t80 -109.8 118.58 36.87 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.709 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -99.14 113.2 25.31 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.482 175.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -62.82 -32.66 73.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.907 -175.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.92 72.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.959 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.455 ' O ' HG13 ' B' ' 74' ' ' ILE . 12.1 mm-40 -112.17 1.06 16.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.198 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 47.47 46.55 17.43 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 124.521 1.138 . . . . 0.0 111.487 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.455 HG13 ' O ' ' B' ' 72' ' ' GLU . 59.3 mt -120.5 136.99 55.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.155 -178.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.46 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -103.36 101.31 11.22 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.431 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -88.76 143.52 26.86 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -178.575 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 48.1 mm -96.11 -60.89 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.271 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.32 -171.56 3.87 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.72 2.27 41.23 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.105 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -85.63 -45.78 11.39 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.506 0.67 . . . . 0.0 109.344 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.446 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -159.32 153.45 23.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.134 -176.108 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 26.7 p -124.49 148.43 47.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.799 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.73 102.07 36.36 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.804 0.335 . . . . 0.0 110.456 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.453 ' HA ' HG12 ' B' ' 74' ' ' ILE . 57.6 Cg_endo -74.22 131.82 15.75 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.081 1.854 . . . . 0.0 111.708 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.5 mt -102.28 146.76 32.9 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.236 -175.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -69.05 139.86 43.78 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.194 1.929 . . . . 0.0 111.673 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.26 -3.11 24.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.468 -176.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -81.26 -13.28 58.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.2 mt -112.52 134.72 54.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.684 -177.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 95.3 t -87.52 109.23 19.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 91' ' ' VAL . . . . . 0.447 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -119.95 135.79 59.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.255 0.55 . . . . 0.0 111.11 -173.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -139.82 165.82 26.27 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.504 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.89 -20.3 63.59 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.491 0.494 . . . . 0.0 111.682 -176.256 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.7 -14.12 46.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -105.78 -23.97 12.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.723 0.773 . . . . 0.0 109.768 -177.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.09 117.08 14.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.387 177.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 25.7 mmmt -110.91 108.27 18.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.091 178.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.476 HG22 HG23 ' A' ' 10' ' ' VAL . 54.3 mt -112.74 119.74 61.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.203 -177.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.833 ' HA ' HG12 ' A' ' 11' ' ' VAL . 75.7 m-85 -128.71 117.01 20.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.87 -178.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.514 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 17.4 t-80 -98.55 113.83 26.01 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.905 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.605 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.8 mp -91.11 126.07 43.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 75.1 mtm180 -80.72 -45.43 17.11 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.354 -173.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.74 -47.5 83.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -177.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.605 ' H ' HG22 ' B' ' 101' ' ' ILE . 45.2 mm-40 -81.62 -1.05 45.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 105' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 104' ' ' GLU . 12.5 ptm180 44.12 41.79 4.44 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.166 0.916 . . . . 0.0 111.42 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -127.46 141.77 51.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.834 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.76 118.66 35.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.41 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.514 ' CE2' HD11 ' B' ' 51' ' ' LEU . 38.4 m-85 -98.62 131.48 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.36 -179.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.6 mm -119.74 123.01 70.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.068 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.416 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 89.1 m-85 -123.53 130.39 52.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 176.298 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.461 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.915 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.9 p . . . . . 0 N--CA 1.451 -0.405 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.47 HG21 ' HB2' ' B' ' 93' ' ' ALA . 28.0 m -128.32 152.24 36.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.552 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -93.05 136.88 32.91 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.4 mm -106.5 124.11 36.7 Favored Pre-proline 0 C--N 1.319 -0.745 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.186 -178.095 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.3 136.87 32.6 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.403 2.069 . . . . 0.0 112.067 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.504 HG23 HG22 ' B' ' 98' ' ' ILE . 2.5 p -114.3 134.11 58.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.267 0.556 . . . . 0.0 110.744 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.825 HG12 ' HA ' ' B' ' 99' ' ' PHE . 4.1 p -89.09 149.12 4.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.664 -179.007 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.52 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 47.5 mt-10 -107.59 94.92 5.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 169.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 9.0 m -117.28 -176.11 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.586 -178.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -104.07 -29.68 10.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 176.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -151.93 166.46 31.42 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.01 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.403 HD22 ' H ' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -84.04 151.33 60.21 Favored Pre-proline 0 N--CA 1.444 -0.736 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.879 177.402 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -53.69 167.57 0.97 Allowed 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 123.523 2.816 . . . . 0.0 113.588 175.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -63.21 130.14 43.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.639 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.6 -9.75 38.16 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.797 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.1 164.1 13.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 111.561 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -103.57 153.83 20.16 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.373 175.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 ttp85 . . . . . 0 C--N 1.321 -0.646 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 171.281 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.455 ' N ' ' HB2' ' B' ' 56' ' ' ALA . 31.0 tt0 . . . . . 0 N--CA 1.446 -0.638 0 CA-C-O 121.472 0.653 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.433 ' HB2' HD21 ' B' ' 81' ' ' LEU . 90.3 m-85 -85.23 146.14 27.22 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.771 179.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.425 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 29.7 tt0 -119.16 108.5 14.74 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 176.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.4 p -96.98 137.25 25.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.48 -175.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.51 146.28 50.87 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.155 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.476 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -126.13 143.08 51.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.519 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 7.8 tmtm? -147.03 137.99 23.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -176.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 8.0 mpt_? -99.08 139.48 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.02 0.438 . . . . 0.0 110.725 -178.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.519 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.8 m-85 -127.02 157.07 40.56 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.222 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.444 ' HB2' ' NZ ' ' B' ' 42' ' ' LYS . 0.0 OUTLIER -156.75 110.18 2.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.654 175.181 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 113.98 -1.34 24.27 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.14 171.83 7.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.567 -0.316 . . . . 0.0 110.328 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.86 -18.48 64.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.201 0.524 . . . . 0.0 110.779 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.593 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -126.39 143.04 51.31 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.805 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.513 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.54 -17.48 15.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.164 0.507 . . . . 0.0 109.832 -176.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.626 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -141.21 132.74 26.97 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.157 179.306 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.623 ' HG3' ' CE1' ' B' ' 110' ' ' TYR . 19.3 ttp180 -115.65 129.27 56.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.794 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.626 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -125.82 127.13 71.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 176.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.514 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 0.9 OUTLIER -115.32 119.55 36.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.195 -177.032 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.16 104.21 14.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.43 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.3 pt-20 -107.78 152.22 24.66 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -103.83 116.12 31.71 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.898 0.38 . . . . 0.0 110.661 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -137.72 93.27 2.77 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.694 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 56' ' ' ALA . . . . . 0.455 ' HB2' ' N ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.253 176.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 . . . . . 0 CA--C 1.513 -0.464 0 CA-C-O 120.754 0.312 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.3 p -135.12 79.54 50.04 Favored Pre-proline 0 C--N 1.317 -0.808 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.498 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.9 Cg_endo -79.44 145.83 18.97 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.379 2.052 . . . . 0.0 112.338 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.2 m -153.42 147.74 25.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.45 -177.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.495 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.5 t80 -113.01 127.64 56.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.081 0.467 . . . . 0.0 111.043 -176.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -105.33 116.46 31.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.172 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -65.9 -32.89 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.608 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.32 -53.3 55.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.535 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.527 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -105.74 7.96 32.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.713 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.72 42.37 19.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.128 0.971 . . . . 0.0 111.752 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.527 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.6 mt -116.04 137.89 48.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.489 -178.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.495 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -108.14 107.02 17.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -94.07 136.36 34.44 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.211 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 34.5 mm -90.98 -47.93 14.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.107 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -159.2 175.61 13.23 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 -173.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.24 9.65 12.73 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.296 174.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -99.54 -37.69 9.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.433 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -162.47 153.69 17.77 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.492 0.663 . . . . 0.0 112.003 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.9 t -129.42 147.89 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.909 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mm -111.39 106.67 57.12 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.999 0.428 . . . . 0.0 110.966 -175.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -74.94 134.36 17.82 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.155 1.903 . . . . 0.0 111.67 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 74.6 mt -102.37 154.95 37.07 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.684 -175.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.469 ' HG2' HD12 ' B' ' 89' ' ' ILE . 40.1 Cg_endo -68.95 141.88 49.88 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.229 1.953 . . . . 0.0 111.865 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.92 -3.14 46.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.486 -176.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.62 -9.36 56.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.287 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.469 HD12 ' HG2' ' B' ' 86' ' ' PRO . 61.2 mt -114.04 134.19 57.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.478 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.25 111.66 22.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 58.6 t -116.05 133.7 61.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.145 0.498 . . . . 0.0 111.038 -173.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.36 160.75 39.47 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.405 177.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.47 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.97 -20.62 64.04 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.173 0.511 . . . . 0.0 111.588 -176.069 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -12.99 56.66 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.249 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -110.07 -24.31 10.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.493 0.663 . . . . 0.0 109.812 -177.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 86.7 mt -69.69 118.35 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.168 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -112.98 107.38 15.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.9 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.504 HG22 HG23 ' A' ' 10' ' ' VAL . 56.8 mt -110.28 121.76 63.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 111.428 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.825 ' HA ' HG12 ' A' ' 11' ' ' VAL . 78.8 m-85 -129.12 118.84 23.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.199 -179.101 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.52 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 23.8 t-80 -104.44 108.64 20.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.136 0.493 . . . . 0.0 110.41 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.638 HG22 ' H ' ' B' ' 104' ' ' GLU . 66.2 mt -86.73 98.61 7.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.439 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 102' ' ' ARG . . . . . 0.434 ' HD2' ' OE2' ' A' ' 12' ' ' GLU . 14.2 ptm180 -74.8 -10.96 60.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.508 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.39 -43.15 74.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.386 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.638 ' H ' HG22 ' B' ' 101' ' ' ILE . 30.0 mm-40 -99.9 -6.86 26.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.454 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 61.35 36.96 17.3 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.502 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.43 HG23 ' HB3' ' B' ' 53' ' ' GLU . 19.4 m -123.26 142.26 51.11 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.373 -176.045 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.15 121.59 44.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.161 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.529 ' CE1' HD12 ' B' ' 101' ' ' ILE . 17.7 m-85 -106.17 130.19 54.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.163 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.575 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.4 mm -118.11 124.43 73.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.623 ' CE1' ' HG3' ' B' ' 49' ' ' ARG . 98.9 m-85 -128.62 125.02 37.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.908 0.385 . . . . 0.0 110.288 177.374 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.593 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 56.2 mt . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.648 -0.692 . . . . 0.0 109.718 -179.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.8 p . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.511 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.6 m -121.38 138.79 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.047 0.451 . . . . 0.0 111.659 -173.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -85.23 138.27 32.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.843 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.573 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.06 117.44 51.81 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -177.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.75 128.28 17.68 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.427 2.085 . . . . 0.0 112.38 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 43.5 t -91.78 131.38 39.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.665 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.8 HG12 ' HA ' ' B' ' 99' ' ' PHE . 2.3 p -87.08 147.57 5.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.573 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.0 mt-10 -115.29 93.98 4.53 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 119.705 -0.798 . . . . 0.0 109.682 168.349 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.418 HG13 HG22 ' A' ' 11' ' ' VAL . 6.9 m -110.92 -179.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.637 -176.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -86.25 -32.63 21.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.527 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.7 pt-20 -170.48 172.05 6.19 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.678 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.415 ' H ' HD22 ' A' ' 16' ' ' LEU . 1.0 OUTLIER -76.7 144.08 72.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-O 120.542 0.21 . . . . 0.0 110.45 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 40.0 Cg_endo -68.08 172.53 10.78 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.278 1.986 . . . . 0.0 111.955 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -57.05 133.64 55.14 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.488 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.25 -11.31 31.25 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.245 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 63.4 m-85 -97.58 159.49 14.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -114.81 95.23 5.12 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.792 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.061 177.795 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 . . . . . 0 N--CA 1.444 -0.748 0 CA-C-O 121.417 0.627 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.2 m-85 -86.89 138.58 31.43 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.487 175.659 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.45 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 22.8 tt0 -118.75 110.04 16.79 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.1 p -97.53 131.71 43.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.358 -174.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.45 ' HE2' ' HG2' ' B' ' 35' ' ' GLU . 0.1 OUTLIER -124.0 132.34 53.69 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.509 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.536 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -113.79 143.24 44.98 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.782 -176.236 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.525 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 7.0 tmtm? -149.47 135.49 18.88 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.12 -0.232 . . . . 0.0 110.473 -176.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.525 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER -92.28 128.98 38.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.009 0.433 . . . . 0.0 111.017 178.419 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.481 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 11.3 m-85 -114.56 138.98 49.97 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.805 176.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -138.55 106.61 5.72 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.164 0.506 . . . . 0.0 109.719 176.017 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 122.19 2.84 9.93 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.741 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -114.6 171.63 7.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.76 -21.06 65.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.341 0.591 . . . . 0.0 110.551 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.674 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.8 p90 -119.28 141.65 48.78 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.789 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.493 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.6 mppt? -105.42 -15.39 15.03 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.454 0.645 . . . . 0.0 109.81 -175.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.654 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.11 130.42 28.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.889 177.503 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 17.8 ttp180 -119.47 123.5 44.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.892 177.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.654 HD11 HD12 ' B' ' 48' ' ' LEU . 1.9 mp -120.54 127.21 75.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.5 mm? -110.1 112.27 24.15 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.046 -178.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -120.02 103.88 14.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.458 ' HB3' HG23 ' B' ' 106' ' ' THR . 15.6 pt-20 -109.58 153.3 24.36 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.633 -178.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -95.56 108.12 20.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.723 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -135.39 92.37 2.84 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.41 0.624 . . . . 0.0 110.255 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.806 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.938 176.632 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 . . . . . 0 CA--C 1.517 -0.326 0 CA-C-O 120.939 0.4 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 41.5 m -138.67 80.3 26.31 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.863 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.475 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 90.1 Cg_endo -82.92 162.23 15.93 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.87 2.38 . . . . 0.0 112.213 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.5 p -162.71 136.49 6.16 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -98.23 115.76 29.04 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.492 -179.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -96.49 114.71 26.39 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.706 176.284 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -63.66 -25.05 68.04 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.428 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.86 71.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.845 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.474 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.56 3.91 17.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.358 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 73' ' ' ASN . . . . . 0.574 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.5 p-10 47.54 45.33 17.51 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.472 1.107 . . . . 0.0 111.469 -174.297 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.474 HG13 ' O ' ' B' ' 72' ' ' GLU . 64.6 mt -123.17 137.11 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.01 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -107.17 103.72 13.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.2 OUTLIER -91.43 141.49 28.69 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.732 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 77' ' ' ILE . . . . . 0.475 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 33.7 mm -95.27 -48.36 12.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.628 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.466 ' C ' ' H ' ' B' ' 80' ' ' LYS . 9.1 t-20 -155.97 171.94 19.23 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.076 -171.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.15 38.65 1.15 Allowed Glycine 0 C--O 1.228 -0.228 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 176.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 80' ' ' LYS . . . . . 0.466 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.2 mmtt -130.45 -41.1 1.23 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -157.95 153.97 27.04 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.205 -175.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 49.1 p -125.61 145.42 50.15 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.226 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.0 mm -111.55 100.43 47.89 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.7 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -71.4 142.82 41.74 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.77 2.313 . . . . 0.0 112.036 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.21 142.54 25.08 Favored Pre-proline 0 C--N 1.318 -0.783 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.016 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.492 ' HG2' HD12 ' B' ' 89' ' ' ILE . 24.9 Cg_endo -63.45 139.24 69.72 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.242 1.962 . . . . 0.0 111.281 176.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.574 ' NE ' HD21 ' B' ' 73' ' ' ASN . 8.7 mpt_? -74.31 -3.18 28.68 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.259 -174.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -80.58 -19.35 45.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.524 0.678 . . . . 0.0 109.566 178.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.492 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.6 mt -104.1 131.48 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.61 -176.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.0 t -84.57 110.23 18.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 1.7 p -120.74 132.44 70.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 121.468 0.652 . . . . 0.0 111.41 -172.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -140.81 164.6 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.194 179.144 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.511 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.51 -21.28 64.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.692 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.94 -15.81 52.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.042 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -106.81 -21.91 12.88 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.65 -177.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.7 mt -74.79 119.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.267 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.497 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.4 mmmt -113.64 106.42 14.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.065 179.045 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.573 HD12 ' HB ' ' A' ' 8' ' ' ILE . 49.8 mt -109.99 121.75 63.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.174 0.511 . . . . 0.0 111.177 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.8 ' HA ' HG12 ' A' ' 11' ' ' VAL . 53.9 m-85 -130.94 124.32 30.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.132 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.573 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 26.9 t-80 -106.38 117.03 32.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.039 0.447 . . . . 0.0 110.578 177.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.611 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.0 mt -99.58 104.84 16.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 172.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.49 -21.58 48.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.403 -174.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -68.81 -43.68 75.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.016 0.436 . . . . 0.0 110.496 176.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.611 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.1 mm-40 -87.73 -7.17 57.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.284 0.564 . . . . 0.0 110.088 177.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 57.06 35.87 26.93 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.51 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.458 HG23 ' HB3' ' B' ' 53' ' ' GLU . 33.2 m -124.43 138.49 54.35 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.623 -174.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.76 123.05 48.85 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.603 ' CE1' HD12 ' B' ' 101' ' ' ILE . 19.4 m-85 -105.73 129.59 53.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.854 -176.475 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.2 mm -117.37 119.62 62.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.858 177.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.47 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.7 m-85 -122.49 122.7 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 176.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.674 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 68.0 mt . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.902 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 4.2 m . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.992 -0.374 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' B' ' 93' ' ' ALA . 31.5 m -123.52 150.0 27.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.027 0.441 . . . . 0.0 110.721 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.44 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 0.1 OUTLIER -91.4 139.66 30.51 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.762 179.099 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.474 ' HB ' HD12 ' B' ' 98' ' ' ILE . 6.0 mm -110.42 119.54 46.48 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.137 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.47 128.44 17.24 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.099 1.866 . . . . 0.0 112.207 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 HG22 ' B' ' 98' ' ' ILE . 2.6 p -105.21 135.48 43.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.811 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.679 HG21 ' HD1' ' B' ' 99' ' ' PHE . 0.9 OUTLIER -86.59 150.04 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.044 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.613 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 35.2 mt-10 -116.58 94.77 4.75 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.862 168.275 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 16.6 m -114.86 -171.3 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.508 -177.249 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -103.4 -23.15 13.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.797 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.425 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.6 pt-20 -170.27 161.68 8.33 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.204 176.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.6 150.03 69.18 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.504 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -72.96 174.17 12.39 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.805 2.337 . . . . 0.0 112.142 176.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -59.66 146.09 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.983 0.421 . . . . 0.0 110.503 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.6 -16.36 54.92 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 111.211 -0.755 . . . . 0.0 111.211 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.33 153.41 18.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -110.51 100.88 9.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.114 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 . . . . . 0 C--N 1.319 -0.723 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.124 -179.954 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 . . . . . 0 N--CA 1.443 -0.8 0 CA-C-O 121.533 0.682 . . . . 0.0 109.733 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 94.3 m-85 -85.07 157.05 20.82 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.767 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.45 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 37.7 tt0 -126.34 112.11 15.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.252 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.3 t -93.55 128.61 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 O-C-N 123.469 0.481 . . . . 0.0 111.183 -177.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.45 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -129.86 119.53 23.47 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.43 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.546 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -104.35 140.56 37.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.431 -175.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.463 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 2.2 tmtp? -149.26 138.08 21.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 110.696 -174.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 8.6 mpt_? -98.75 135.84 39.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.201 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.463 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 26.6 m-85 -115.14 143.51 45.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.188 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -127.56 101.92 6.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.336 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.55 32.04 6.17 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.541 -0.837 . . . . 0.0 112.519 178.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.19 172.1 10.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.84 -27.26 63.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.447 0.641 . . . . 0.0 110.531 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.661 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.3 p90 -120.59 143.87 48.41 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.748 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.503 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.7 mppt? -101.82 -22.35 14.38 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.418 -176.185 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.603 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.94 132.92 31.12 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.815 -178.423 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -119.75 129.57 54.56 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.603 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -124.7 127.96 73.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.494 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.1 mm? -111.04 121.54 45.62 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 52' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 4.5 mp -126.18 102.67 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 177.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.8 pt-20 -112.34 154.34 25.87 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.12 0.486 . . . . 0.0 110.628 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -99.1 111.35 23.76 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.535 -176.036 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.79 92.57 2.91 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.504 0.669 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.287 176.51 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 120.822 0.344 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -138.8 79.81 26.97 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-O 121.231 0.539 . . . . 0.0 109.745 175.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.463 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 66.8 Cg_endo -77.1 150.81 29.88 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.735 2.29 . . . . 0.0 112.345 -178.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 17.0 m -153.57 143.63 22.12 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.338 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.416 ' HB2' HD23 ' B' ' 75' ' ' LEU . 63.1 t80 -104.54 113.4 26.94 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.296 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.6 OUTLIER -95.57 108.26 20.5 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.502 177.128 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -60.03 -28.35 67.68 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.19 -44.37 64.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.248 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.512 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.4 mt-10 -114.15 3.38 15.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.996 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 8.2 p30 47.8 43.74 17.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.068 0.947 . . . . 0.0 111.453 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.512 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.0 mt -121.93 138.09 53.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.142 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.416 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -100.42 101.68 12.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.463 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -89.19 139.48 30.44 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.511 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.8 mm -91.73 -53.23 9.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.499 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.4 p30 -162.48 -165.99 1.28 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.866 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.63 0.59 69.91 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.686 178.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -92.22 -42.4 9.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.491 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -158.63 153.74 25.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.935 -178.964 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 31.3 t -133.53 150.2 51.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.325 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.4 mm -114.79 105.73 52.88 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.999 0.428 . . . . 0.0 110.95 -174.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.29 136.06 11.12 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.422 2.082 . . . . 0.0 112.599 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.73 146.67 32.25 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.102 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.51 ' HG2' HD12 ' B' ' 89' ' ' ILE . 23.3 Cg_endo -62.49 141.7 87.59 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.459 2.106 . . . . 0.0 111.654 176.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -73.88 -7.06 50.85 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.55 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' ASP . . . . . 0.502 ' OD1' ' HB2' ' B' ' 86' ' ' PRO . 4.6 p-10 -89.29 -4.19 58.23 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.876 0.37 . . . . 0.0 110.781 -178.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.51 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.7 mt -112.29 135.55 51.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.318 179.009 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -87.21 116.34 29.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.299 0.571 . . . . 0.0 110.19 177.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 54.1 t -121.91 133.56 67.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.293 0.568 . . . . 0.0 111.184 -174.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.27 159.3 42.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.566 177.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.451 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -64.12 -16.67 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.875 -175.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.73 -14.14 49.21 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.025 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -109.31 -22.35 12.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.353 0.597 . . . . 0.0 109.978 -177.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.436 HG22 HG13 ' B' ' 98' ' ' ILE . 85.6 mt -71.4 117.42 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.619 176.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.469 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 26.0 mmmt -112.28 104.7 12.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.677 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.545 HG22 HG23 ' A' ' 10' ' ' VAL . 53.5 mt -108.87 117.89 55.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.198 0.523 . . . . 0.0 111.48 -177.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.679 ' HD1' HG21 ' A' ' 11' ' ' VAL . 96.1 m-85 -127.78 121.96 31.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.451 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 t-80 -104.93 123.13 47.22 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 110.173 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.741 HG22 ' H ' ' B' ' 104' ' ' GLU . 52.4 mt -99.05 120.65 48.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.154 0.502 . . . . 0.0 109.846 175.224 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 102' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' B' ' 102' ' ' ARG . 3.9 ptt180 -75.77 -35.91 59.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.756 -176.249 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.28 -41.27 66.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.101 0.477 . . . . 0.0 110.53 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.741 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.3 tp10 -81.09 -10.9 59.6 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.397 -178.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 30.5 mmm180 58.57 29.49 18.52 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.11 -178.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.485 HG23 ' HB3' ' B' ' 53' ' ' GLU . 85.4 m -127.08 139.77 52.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.59 -168.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.49 120.64 43.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.521 177.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.494 ' CE2' HD11 ' B' ' 51' ' ' LEU . 23.7 m-85 -101.33 125.29 47.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.714 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.508 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.8 mm -113.64 116.39 52.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.114 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 80.2 m-85 -117.36 124.55 49.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 175.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.661 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.0 mt . . . . . 0 C--O 1.245 0.834 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.592 178.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.452 -0.346 0 CA-C-O 120.733 0.302 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.413 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.3 m -130.42 142.15 44.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.345 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.41 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -86.93 137.72 32.13 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.684 0.278 . . . . 0.0 110.251 -178.306 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.403 HG12 ' HA ' ' B' ' 67' ' ' SER . 4.5 mm -110.32 120.57 43.87 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -76.81 135.35 15.77 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.243 1.962 . . . . 0.0 112.068 177.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.1 t -85.06 132.93 30.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.605 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.499 HG12 HG13 ' A' ' 13' ' ' VAL . 82.0 t -95.93 112.21 27.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 172.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.523 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 40.7 mt-10 -91.42 110.15 21.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.453 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.499 HG13 HG12 ' A' ' 11' ' ' VAL . 2.5 m -130.31 -176.18 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.662 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -84.09 -30.04 26.3 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -172.78 -178.65 1.92 Allowed 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.158 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.468 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.4 mm? -77.46 150.83 80.09 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-O 120.808 0.337 . . . . 0.0 110.129 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -65.39 172.63 7.48 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.544 2.163 . . . . 0.0 111.535 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.94 139.67 56.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.354 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.21 -15.38 50.86 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.94 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -84.64 173.29 10.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.762 0.315 . . . . 0.0 110.459 176.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -126.89 100.07 6.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.989 0.423 . . . . 0.0 110.826 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.468 ' HB2' HD23 ' A' ' 16' ' ' LEU . 56.7 ttp85 . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.286 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 . . . . . 0 N--CA 1.445 -0.715 0 CA-C-O 121.348 0.594 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.0 m-85 -83.35 144.05 29.93 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.13 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -120.54 114.43 21.74 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 60.4 t -96.96 129.43 47.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.47 -174.214 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.419 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -123.0 136.37 54.83 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.744 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.728 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.7 OUTLIER -117.1 127.34 54.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.95 0.405 . . . . 0.0 110.922 -179.274 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.651 ' O ' HD13 ' B' ' 48' ' ' LEU . 7.3 tmtm? -125.42 118.48 25.96 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -175.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.419 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 6.6 mpt_? -90.09 127.12 36.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.257 0.551 . . . . 0.0 111.52 -172.127 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.592 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 25.5 m-85 -109.28 167.74 9.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.86 176.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.92 127.17 9.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.465 174.472 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 74.56 33.75 55.35 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.472 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.17 172.18 10.77 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.768 -0.254 . . . . 0.0 110.401 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.52 -22.96 65.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.293 0.568 . . . . 0.0 110.5 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.645 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -130.83 142.06 50.37 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.958 178.898 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.504 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.99 -19.21 18.16 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.059 0.457 . . . . 0.0 109.83 -176.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.728 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.0 OUTLIER -143.22 134.74 26.3 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.234 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.401 ' HB2' ' CE1' ' B' ' 41' ' ' PHE . 34.4 ttp180 -113.73 113.0 24.37 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 171.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.583 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.1 mp -108.34 127.86 64.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.8 mm? -110.12 117.96 35.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.282 -177.201 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.93 103.71 13.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 16.5 pt-20 -113.23 153.79 27.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.968 0.413 . . . . 0.0 110.543 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -96.85 112.67 24.32 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.899 -177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -138.43 91.32 2.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.027 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.659 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.947 172.802 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 . . . . . 0 CA--C 1.509 -0.627 0 CA-C-O 121.665 0.745 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 19.4 t -142.23 78.96 16.36 Favored Pre-proline 0 C--N 1.305 -1.337 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.803 172.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.415 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 71.9 Cg_endo -78.65 156.64 28.05 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.937 2.425 . . . . 0.0 112.402 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 67' ' ' SER . . . . . 0.473 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 20.3 m -158.51 144.88 17.18 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.229 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.451 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.7 t80 -106.39 119.04 38.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.583 -177.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -100.02 113.47 26.08 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.37 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -62.71 -32.09 73.13 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.631 -177.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.62 -50.12 63.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.666 -178.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 3.0 mm-40 -103.6 1.6 32.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.391 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 46.97 46.07 15.67 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 124.375 1.047 . . . . 0.0 111.537 -175.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.7 mt -124.0 138.41 53.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.191 -178.201 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.451 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -104.82 102.26 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.412 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.473 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -88.75 138.6 31.27 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.59 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 77' ' ' ILE . . . . . 0.415 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 34.9 mm -92.3 -46.53 14.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.084 -175.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -150.26 -179.94 7.61 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.65 1.94 60.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.585 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -101.35 -33.97 9.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.626 -0.287 . . . . 0.0 111.146 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -154.4 153.32 31.39 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.309 0.576 . . . . 0.0 112.226 178.543 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 33.1 p -129.73 151.78 49.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.178 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mm -111.9 105.01 56.51 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 120.849 0.357 . . . . 0.0 110.514 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -80.34 135.78 10.91 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.632 2.221 . . . . 0.0 112.713 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -103.14 148.26 35.37 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.17 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.431 ' HG2' HD12 ' B' ' 89' ' ' ILE . 32.6 Cg_endo -66.63 137.73 47.07 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.18 1.92 . . . . 0.0 111.389 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.465 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 0.0 OUTLIER -70.5 -3.99 20.62 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.739 -175.832 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.62 -11.58 58.29 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.465 0.65 . . . . 0.0 109.972 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.431 HD12 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -107.59 132.04 56.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.534 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 57.8 t -82.91 110.59 18.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 175.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 49.1 t -115.34 132.77 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.67 -174.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 92' ' ' ASN . . . . . 0.467 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.27 162.2 36.04 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.617 177.481 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.413 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.63 -17.82 63.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.89 -175.251 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.26 -16.41 40.25 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.794 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 95' ' ' ASP . . . . . 0.467 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 21.0 t0 -104.57 -23.07 13.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.547 0.689 . . . . 0.0 109.672 -176.04 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.44 114.6 13.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.969 177.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.426 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 24.1 mmmt -108.56 105.96 15.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.808 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 48.9 mt -109.38 116.18 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.373 . . . . 0.0 110.856 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.427 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.7 m-85 -129.39 119.83 24.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -177.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.523 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.8 t-80 -102.62 114.2 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.314 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.552 HG22 ' H ' ' B' ' 104' ' ' GLU . 4.2 mp -95.87 101.14 12.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 171.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -78.5 -15.8 58.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.471 -174.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.44 -41.64 80.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.877 0.37 . . . . 0.0 110.152 175.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.552 ' H ' HG22 ' B' ' 101' ' ' ILE . 13.6 mm-40 -94.32 -3.67 50.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.493 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 59.15 35.78 23.79 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.404 -177.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.424 HG23 ' HB3' ' B' ' 53' ' ' GLU . 27.6 m -125.63 134.75 51.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.982 0.42 . . . . 0.0 110.866 -173.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 49.3 tp -108.63 117.49 34.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.232 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.553 ' CE2' HD11 ' B' ' 51' ' ' LEU . 35.7 m-85 -97.78 129.1 44.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.081 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.58 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 42.2 mm -116.06 123.1 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.961 176.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 83.7 m-85 -121.34 127.54 51.38 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.645 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 65.3 mt . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.594 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.3 p . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.61 0.243 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.529 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.2 m -127.45 144.37 37.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.676 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -84.98 138.68 32.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.072 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.7 mm -107.56 119.85 49.26 Favored Pre-proline 0 C--N 1.321 -0.656 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.119 178.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.38 135.62 24.86 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.557 2.171 . . . . 0.0 112.575 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -93.54 124.23 45.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.566 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.454 HG12 HG13 ' A' ' 13' ' ' VAL . 58.7 t -92.55 118.47 38.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.439 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.8 mt-10 -94.0 111.02 22.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.379 0.609 . . . . 0.0 110.269 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.454 HG13 HG12 ' A' ' 11' ' ' VAL . 2.7 m -127.74 -175.81 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.107 -177.542 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -85.97 -29.75 23.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.519 ' HA ' HG12 ' B' ' 101' ' ' ILE . 13.0 pt-20 -178.28 175.26 1.21 Allowed 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.077 173.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.463 ' H ' HD22 ' A' ' 16' ' ' LEU . 1.8 mm? -71.88 153.62 92.96 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.788 0.327 . . . . 0.0 111.119 -174.001 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.81 173.04 15.1 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.193 1.929 . . . . 0.0 111.446 174.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.25 138.76 57.87 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.619 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.61 -10.46 41.89 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.831 -175.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.4 ' HA ' ' OH ' ' B' ' 46' ' ' TYR . 60.6 m-85 -103.92 152.65 21.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.992 0.425 . . . . 0.0 111.598 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -112.91 104.0 11.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.327 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.626 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 63.7 ttp85 . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.159 -176.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.496 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 41.9 tt0 . . . . . 0 N--CA 1.447 -0.62 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.494 ' HB2' HD21 ' B' ' 81' ' ' LEU . 81.4 m-85 -87.35 155.98 19.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.927 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -130.21 118.06 20.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.961 175.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -95.96 138.89 20.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.822 -174.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.482 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -132.52 151.75 51.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 175.312 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -132.77 141.7 48.64 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 8.7 tmtm? -144.88 135.76 24.74 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.636 -176.22 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.488 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 7.6 mpt_? -98.61 129.48 45.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.995 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.474 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 31.3 m-85 -107.91 146.9 31.73 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.5 177.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -129.37 100.11 5.45 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.903 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 93.39 45.19 3.55 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.203 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -133.45 170.74 15.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.78 -17.04 63.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.281 0.562 . . . . 0.0 110.776 177.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.536 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -130.34 140.16 50.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 47' ' ' LYS . . . . . 0.538 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -95.28 -24.37 16.8 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.226 0.536 . . . . 0.0 109.668 -174.49 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.588 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.59 136.76 37.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.249 -177.3 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -120.72 129.58 53.7 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.588 HD11 HD12 ' B' ' 48' ' ' LEU . 2.6 mp -123.03 129.85 74.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.0 mm? -114.26 118.89 35.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.51 -175.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -124.36 103.53 12.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.53 ' HB3' HG23 ' B' ' 106' ' ' THR . 13.1 pt-20 -107.22 153.65 22.38 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.579 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -99.23 112.46 24.61 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.646 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -136.88 92.82 2.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.37 0.605 . . . . 0.0 110.682 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 56' ' ' ALA . . . . . 0.496 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.322 -0.589 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.178 176.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 . . . . . 0 N--CA 1.451 -0.406 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.7 p -136.38 79.46 42.25 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.169 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.404 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 91.4 Cg_endo -87.8 153.86 7.37 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.828 2.352 . . . . 0.0 112.391 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 67' ' ' SER . . . . . 0.418 ' HA ' HG12 ' A' ' 8' ' ' ILE . 24.7 m -157.18 150.29 23.74 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.501 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.421 ' HB2' HD23 ' B' ' 75' ' ' LEU . 48.8 t80 -109.05 125.45 52.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.507 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -106.54 117.93 35.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -70.17 -14.92 62.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.828 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.13 -50.94 71.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.101 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.434 ' O ' HD13 ' B' ' 74' ' ' ILE . 6.3 mm-40 -113.36 0.1 14.68 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.307 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 73' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' B' ' 85' ' ' LEU . 1.8 p-10 51.35 48.28 23.27 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 124.712 1.257 . . . . 0.0 111.014 -171.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' B' ' 84' ' ' PRO . 0.3 OUTLIER -107.27 146.97 12.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.736 177.671 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.427 ' HB2' HD11 ' B' ' 85' ' ' LEU . 3.2 tm? -115.72 102.38 9.68 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.1 OUTLIER -91.07 139.93 30.3 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -178.565 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.0 mm -93.25 -46.42 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.618 -174.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.429 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.2 t-20 -161.93 178.59 8.75 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -175.006 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.17 32.83 1.31 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.195 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 80' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' B' ' 78' ' ' ASN . 28.2 mmmt -125.07 -44.66 1.9 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.494 HD21 ' HB2' ' B' ' 34' ' ' TYR . 1.0 OUTLIER -152.25 153.65 34.18 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.784 -177.978 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 13.3 p -126.52 145.82 50.36 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.055 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.6 mm -107.83 111.07 62.55 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.603 -178.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.602 ' HA ' HD12 ' B' ' 74' ' ' ILE . 59.8 Cg_endo -75.69 132.8 14.88 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.992 1.795 . . . . 0.0 111.899 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 78.7 mt -102.6 148.26 35.25 Favored Pre-proline 0 C--N 1.323 -0.561 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.773 -176.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.93 142.93 43.89 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.739 2.293 . . . . 0.0 112.327 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.431 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 9.1 mpt_? -79.07 -6.48 56.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.931 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -79.52 -18.83 51.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.639 0.733 . . . . 0.0 109.714 179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 55.8 mt -107.56 131.5 57.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.773 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.2 115.83 27.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 91' ' ' VAL . . . . . 0.411 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -126.24 134.85 65.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.324 0.583 . . . . 0.0 111.222 -173.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.79 164.91 28.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.855 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.529 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.77 -16.85 62.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.867 -175.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.48 -12.41 43.08 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.177 0.513 . . . . 0.0 110.905 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -109.24 -26.87 9.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.951 -176.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 96' ' ' ILE . . . . . 0.406 HG22 HG13 ' B' ' 98' ' ' ILE . 82.5 mt -69.79 114.98 7.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.04 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.414 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.1 mmmt -108.45 103.42 12.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.401 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.428 HD12 ' HB ' ' A' ' 8' ' ' ILE . 40.4 mt -107.14 121.51 60.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.796 179.164 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.436 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 76.3 m-85 -134.56 121.2 20.61 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.275 -178.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.439 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 17.5 t-80 -96.34 110.75 23.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.463 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.811 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.2 mp -91.87 107.55 18.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 173.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -73.85 -23.19 59.58 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.971 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -60.64 -47.59 85.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.164 0.507 . . . . 0.0 110.643 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.811 ' H ' HG22 ' B' ' 101' ' ' ILE . 15.6 mm-40 -92.61 -3.42 55.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.641 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 57.99 34.39 24.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.128 -176.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.53 HG23 ' HB3' ' B' ' 53' ' ' GLU . 41.2 m -129.16 141.6 51.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.201 -170.213 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.8 tp -107.12 120.31 41.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.007 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.706 ' CD1' HD13 ' B' ' 101' ' ' ILE . 21.2 m-85 -102.6 130.61 49.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.014 -178.023 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.571 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.5 mm -115.49 120.23 64.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.9 177.427 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.441 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.7 m-85 -121.01 126.66 50.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.536 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.646 -0.692 . . . . 0.0 109.82 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 2.0 m . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.515 HG21 ' HB2' ' B' ' 93' ' ' ALA . 24.4 m -135.33 152.87 32.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.705 0.288 . . . . 0.0 110.647 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.76 138.38 34.41 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.6 mm -111.86 121.26 40.15 Favored Pre-proline 0 C--N 1.323 -0.565 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.311 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.64 130.34 18.09 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.05 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.468 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -100.77 127.1 54.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.188 0.518 . . . . 0.0 110.667 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.565 HG12 HG13 ' A' ' 13' ' ' VAL . 83.0 t -95.5 123.07 47.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.128 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.2 mt-10 -92.19 109.69 21.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.479 0.657 . . . . 0.0 110.514 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.565 HG13 HG12 ' A' ' 11' ' ' VAL . 3.5 m -126.22 -176.12 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.423 -176.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -91.27 -25.64 19.38 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.436 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.5 pt-20 -171.51 170.54 5.75 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.75 176.351 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.478 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.1 mm? -74.1 151.63 88.26 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.521 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -59.41 171.54 2.44 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.374 2.049 . . . . 0.0 111.81 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.74 130.67 42.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.044 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.86 -6.33 29.32 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.375 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.76 164.45 14.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.923 0.392 . . . . 0.0 111.363 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -115.83 97.36 6.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.363 -177.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.498 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 35.1 ttp85 . . . . . 0 C--N 1.322 -0.591 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.424 -175.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.405 ' CB ' ' HB2' ' B' ' 56' ' ' ALA . 23.8 tt0 . . . . . 0 N--CA 1.45 -0.467 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.529 ' HB2' HD21 ' B' ' 81' ' ' LEU . 77.4 m-85 -88.09 142.71 27.56 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.297 176.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -122.58 112.03 17.5 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.43 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 56.9 t -96.93 136.67 26.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.027 -171.62 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 9.0 mptt -132.52 132.62 42.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 174.43 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 38' ' ' MET . . . . . 0.565 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -113.57 138.82 49.61 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.473 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.542 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 9.8 tmtm? -143.49 136.63 27.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.948 0.404 . . . . 0.0 110.706 -176.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -100.95 135.94 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.825 -177.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 41' ' ' PHE . . . . . 0.542 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.6 m-85 -111.83 155.73 23.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.987 0.422 . . . . 0.0 110.709 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -127.21 119.25 25.97 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.968 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 63.41 46.98 91.4 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.415 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -126.57 171.04 11.44 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.58 -2.74 18.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.96 0.409 . . . . 0.0 111.101 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 46' ' ' TYR . . . . . 0.535 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.2 OUTLIER -150.06 128.15 11.95 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.913 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -84.49 -28.54 26.69 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.216 -173.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.638 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -133.59 135.78 44.49 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.65 -178.403 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -121.39 125.28 46.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.527 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' ILE . . . . . 0.638 HD11 HD12 ' B' ' 48' ' ' LEU . 1.8 mp -122.26 129.47 75.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.646 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -111.99 114.88 28.03 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.633 -178.119 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.18 104.53 14.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.459 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 14.9 pt-20 -108.41 153.08 23.8 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.339 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -97.3 110.33 22.9 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.528 -179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -137.32 91.59 2.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.086 0.47 . . . . 0.0 110.815 178.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 56' ' ' ALA . . . . . 0.405 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.321 -0.639 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.534 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 . . . . . 0 N--CA 1.449 -0.515 0 CA-C-O 120.805 0.336 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 10.9 m -135.33 78.97 50.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 66' ' ' PRO . . . . . 0.472 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.3 Cg_endo -77.19 149.18 27.95 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.312 2.008 . . . . 0.0 112.088 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.7 m -154.28 141.89 19.86 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.239 -179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.456 ' HB2' HD23 ' B' ' 75' ' ' LEU . 43.1 t80 -105.74 113.06 26.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.311 -178.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' ASN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.5 OUTLIER -95.63 106.1 18.16 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 176.253 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -56.42 -34.07 66.42 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.335 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.72 -45.21 58.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.859 -176.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 72' ' ' GLU . . . . . 0.523 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.0 mt-10 -112.31 5.31 18.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.096 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' ASN . . . . . 0.452 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.6 p-10 48.86 42.31 19.99 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.755 1.284 . . . . 0.0 111.6 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.523 HG13 ' O ' ' B' ' 72' ' ' GLU . 65.7 mt -118.75 135.77 58.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.168 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.456 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -103.67 102.99 12.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.472 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -89.75 141.47 28.59 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -178.737 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 43.2 mm -97.97 -45.75 12.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.863 -176.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.406 ' OD1' ' HG2' ' B' ' 80' ' ' LYS . 3.3 t-20 -156.53 176.48 12.65 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.013 -172.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.14 2.4 44.02 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 80' ' ' LYS . . . . . 0.406 ' HG2' ' OD1' ' B' ' 78' ' ' ASN . 44.1 mmtm -89.22 -43.94 10.63 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 81' ' ' LEU . . . . . 0.529 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -157.0 153.46 28.03 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.495 0.664 . . . . 0.0 112.495 -176.258 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 15.8 p -124.28 146.91 48.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.812 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -108.18 102.35 45.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 120.888 0.375 . . . . 0.0 110.774 -177.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.46 ' HA ' HG12 ' B' ' 74' ' ' ILE . 60.5 Cg_endo -75.81 126.09 9.22 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.213 1.942 . . . . 0.0 112.127 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 83.5 mt -92.63 154.92 42.38 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.465 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 86' ' ' PRO . . . . . 0.436 ' HG2' HD12 ' B' ' 89' ' ' ILE . 39.3 Cg_endo -68.53 138.49 42.15 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 111.877 176.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 87' ' ' ARG . . . . . 0.452 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.1 mpt_? -80.69 -0.2 37.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -87.68 -10.35 51.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.386 0.612 . . . . 0.0 110.362 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 89' ' ' ILE . . . . . 0.516 ' CD1' HD23 ' B' ' 48' ' ' LEU . 57.4 mt -112.47 137.77 44.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.196 -175.085 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 64.6 t -83.19 111.73 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.917 177.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 92.7 t -118.69 131.32 71.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.597 0.713 . . . . 0.0 111.652 -174.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.35 159.89 41.34 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.228 176.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 93' ' ' ALA . . . . . 0.515 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -64.64 -14.79 59.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.12 0.486 . . . . 0.0 111.55 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.12 -26.19 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.077 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.38 -26.27 14.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.991 0.424 . . . . 0.0 110.582 -178.307 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 89.6 mt -69.0 113.4 4.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.764 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -110.41 108.15 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.875 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 98' ' ' ILE . . . . . 0.468 HG22 HG23 ' A' ' 10' ' ' VAL . 50.7 mt -111.92 116.39 52.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.85 0.357 . . . . 0.0 110.861 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 99' ' ' PHE . . . . . 0.409 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.3 m-85 -128.62 119.09 24.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.471 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 100' ' ' HIS . . . . . 0.475 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 13.1 t-80 -98.07 110.21 22.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.575 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 101' ' ' ILE . . . . . 0.636 HG22 ' H ' ' B' ' 104' ' ' GLU . 61.1 mt -91.28 104.57 15.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.649 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 102' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' B' ' 100' ' ' HIS . 20.7 mtm180 -76.12 -28.24 57.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.895 -177.466 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -59.9 -42.16 93.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.798 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.636 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.0 tp10 -99.05 -0.93 40.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.174 -177.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 58.61 30.24 19.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.788 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 106' ' ' THR . . . . . 0.4 HG23 ' HB3' ' B' ' 53' ' ' GLU . 28.0 m -127.99 139.22 52.69 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.016 0.436 . . . . 0.0 111.155 -172.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.8 tp -109.05 120.23 41.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.296 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 108' ' ' TYR . . . . . 0.646 ' CE2' HD11 ' B' ' 51' ' ' LEU . 31.5 m-85 -102.08 127.0 49.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 109' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 32.6 mm -113.87 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.798 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 110' ' ' TYR . . . . . 0.489 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.0 m-85 -122.32 126.5 48.22 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.591 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 111' ' ' ILE . . . . . 0.535 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 55.4 mt . . . . . 0 C--O 1.245 0.865 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.309 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.12 70.44 7.12 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 123.188 2.592 . . . . 0.0 111.873 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -79.92 72.29 6.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.348 0.594 . . . . 0.0 110.71 -177.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 50.0 ttm -122.96 126.74 47.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.929 175.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 1.5 m -140.67 132.76 27.9 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.563 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' B' ' 93' ' ' ALA . 17.5 m -119.57 143.1 32.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 120.829 0.347 . . . . 0.0 110.795 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.41 137.4 33.41 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.4 mm -105.41 121.05 47.49 Favored Pre-proline 0 C--N 1.319 -0.747 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.101 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.86 125.71 12.96 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.196 1.931 . . . . 0.0 111.956 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.492 HG23 HG22 ' B' ' 98' ' ' ILE . 2.2 p -103.31 127.98 56.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.551 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.566 HG12 HG13 ' A' ' 13' ' ' VAL . 44.2 t -95.04 125.17 47.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.816 178.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.455 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 35.3 mt-10 -93.25 96.05 9.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.637 0.732 . . . . 0.0 110.428 178.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.593 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 5.0 m -107.27 177.49 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.208 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.09 -14.02 24.61 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.401 ' HA ' HG12 ' B' ' 101' ' ' ILE . 12.9 pt-20 -178.61 166.83 1.77 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.596 -1.183 . . . . 0.0 109.677 173.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.1 mm? -73.73 149.6 88.21 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.532 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.03 168.18 21.35 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.432 2.088 . . . . 0.0 111.516 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.23 140.22 57.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -24.31 18.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.688 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -86.06 164.32 17.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.016 0.436 . . . . 0.0 111.087 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.59 95.49 5.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.645 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.524 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.4 ttt-85 -101.18 147.38 26.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.0 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 m . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.651 -0.69 . . . . 0.0 109.656 179.857 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.478 0.602 0 N-CA-C 110.623 -0.568 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -127.73 -44.74 1.49 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.833 0.349 . . . . 0.0 110.636 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -144.11 34.02 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.134 0.492 . . . . 0.0 110.765 -177.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 mp0 -97.45 145.93 25.71 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.587 177.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -132.2 153.65 50.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.482 0.658 . . . . 0.0 111.551 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -129.83 -12.01 4.29 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.787 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.95 -10.56 59.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.486 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 98.3 t -68.05 122.29 83.37 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.201 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -69.89 130.03 18.48 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.599 2.199 . . . . 0.0 112.083 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -113.41 99.05 7.48 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.126 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.468 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 83.5 m-85 -89.86 152.82 21.07 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -129.65 119.05 22.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 51.9 t -97.48 132.12 42.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.533 -175.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -125.88 132.91 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 176.187 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.649 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.7 ttt -118.14 139.34 51.4 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.505 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.509 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.3 tmtp? -144.9 132.73 21.19 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.309 -175.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.468 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -94.3 134.12 37.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.265 -176.55 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.509 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.9 m-85 -121.55 134.98 55.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.804 179.08 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -116.22 118.82 33.85 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.499 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.21 19.76 62.0 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.386 175.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -108.62 172.07 7.06 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 122.709 -0.289 . . . . 0.0 110.492 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.82 -20.37 63.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.343 0.592 . . . . 0.0 110.434 176.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.613 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -128.87 141.57 51.24 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.561 177.73 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.51 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -98.05 -21.45 16.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.229 0.537 . . . . 0.0 109.622 -176.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.649 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.09 132.83 29.02 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.235 -179.176 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 31.9 ttp180 -114.71 121.23 42.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.554 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.4 mp -118.52 128.54 75.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.549 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.3 mm? -114.98 121.09 42.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.442 -177.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -125.31 104.25 13.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.5 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.8 pt-20 -107.06 153.36 22.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.982 0.42 . . . . 0.0 110.614 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -98.14 107.41 19.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.129 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -130.05 93.78 3.57 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.458 0.647 . . . . 0.0 110.346 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.531 ' HB1' ' HD2' ' B' ' 57' ' ' PRO . . . -137.29 167.32 21.29 Favored Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.505 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.531 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 9.8 Cg_endo -52.3 -49.66 16.65 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.089 1.86 . . . . 0.0 110.703 176.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -126.16 -75.62 0.59 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.623 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.505 ' HB2' ' HB3' ' B' ' 56' ' ' ALA . 38.9 t 68.45 138.56 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.348 -176.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' B' ' 60' ' ' LYS . 13.9 ptmm? -129.95 74.94 80.15 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.695 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -69.7 141.87 46.65 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 121.954 1.769 . . . . 0.0 111.341 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -108.56 -69.78 0.84 Allowed 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.133 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.516 ' H ' ' HD2' ' B' ' 63' ' ' ARG . 0.0 OUTLIER -127.16 166.22 18.1 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.083 0.468 . . . . 0.0 110.898 -177.792 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -127.08 111.1 13.64 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.418 173.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 16.0 m -129.95 79.89 72.25 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-O 121.153 0.502 . . . . 0.0 109.778 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.442 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 63.9 Cg_endo -79.68 150.41 21.49 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 111.784 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 67' ' ' SER . . . . . 0.506 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 14.1 m -154.03 142.38 20.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.491 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.415 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 59.7 t80 -104.56 118.47 36.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.493 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.475 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.2 p30 -100.05 115.27 29.35 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.748 177.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -64.25 -28.2 69.57 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.506 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.75 -46.63 70.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.407 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.499 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -112.46 2.44 16.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.568 -177.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' ASN . . . . . 0.444 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.1 p-10 48.37 45.56 20.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.38 1.072 . . . . 0.0 111.822 -175.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.499 HG13 ' O ' ' B' ' 72' ' ' GLU . 66.9 mt -124.07 137.95 55.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.152 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.412 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -102.9 104.21 14.43 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.5 p90 -93.07 142.1 27.67 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.84 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.1 mm -88.24 -54.02 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 -177.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 41.3 m-20 -153.25 176.91 11.43 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.3 40.63 1.75 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.56 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' LYS . . . . . 0.639 ' HD3' ' O ' ' B' ' 80' ' ' LYS . 0.0 OUTLIER -131.23 -36.53 1.3 Allowed 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.517 ' HG ' ' HG3' ' B' ' 80' ' ' LYS . 0.2 OUTLIER -154.53 153.53 31.61 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.441 0.638 . . . . 0.0 111.704 175.37 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 21.2 p -130.47 148.99 52.34 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.274 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mm -107.84 102.53 45.79 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 120.819 0.342 . . . . 0.0 110.178 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.85 135.13 17.2 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.208 1.939 . . . . 0.0 112.117 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -97.59 141.09 22.47 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.559 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -64.76 139.62 63.77 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.986 1.791 . . . . 0.0 110.761 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.444 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.6 mpt_? -70.82 -0.99 10.2 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.789 -174.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -79.28 -16.79 55.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.534 0.683 . . . . 0.0 109.714 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -110.04 137.1 43.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.6 p -92.32 112.37 25.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' VAL . . . . . 0.415 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.5 p -121.38 139.32 48.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.306 0.574 . . . . 0.0 111.218 -174.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.427 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -140.5 164.69 29.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.011 -178.983 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.451 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -59.83 -23.53 63.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.058 0.456 . . . . 0.0 111.577 -176.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.06 -16.48 43.63 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.279 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.427 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 26.7 t70 -102.51 -24.27 13.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.683 0.754 . . . . 0.0 109.563 -176.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.442 HG22 HG13 ' B' ' 98' ' ' ILE . 81.3 mt -72.78 115.55 13.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.306 177.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.461 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -109.47 106.49 16.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.718 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.492 HG22 HG23 ' A' ' 10' ' ' VAL . 57.2 mt -110.99 121.14 63.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.447 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -134.54 124.43 25.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.367 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.455 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 22.5 t-80 -105.5 113.09 26.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.715 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.593 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 3.0 mp -89.37 118.39 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 175.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 62.8 mtp85 -81.76 -23.71 36.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.866 -177.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -57.94 -43.33 86.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.14 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.512 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.0 pt-20 -110.0 0.98 18.72 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.456 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 58.27 38.49 26.08 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.63 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.5 HG23 ' HB3' ' B' ' 53' ' ' GLU . 29.1 m -117.73 137.92 52.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 120.921 0.391 . . . . 0.0 110.674 -176.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.25 114.35 28.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.875 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.549 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.2 m-85 -93.48 125.44 38.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.377 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.542 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 44.0 mm -115.04 121.95 68.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.109 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.461 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.0 m-85 -121.8 127.83 51.02 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.613 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.3 mt . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.783 -0.627 . . . . 0.0 109.767 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.419 ' HD2' ' HB1' ' B' ' 71' ' ' ALA . 94.6 Cg_endo -77.05 56.07 5.26 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.01 2.473 . . . . 0.0 113.126 -177.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.467 ' O ' ' HB3' ' A' ' 4' ' ' MET . 3.4 t-160 -162.65 -78.09 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 176.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.467 ' HB3' ' O ' ' A' ' 3' ' ' HIS . 22.3 ptp 172.0 158.35 0.09 Allowed 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.748 0.655 . . . . 0.0 109.325 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.0 p -136.37 128.1 29.04 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.701 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.496 HG21 ' HB2' ' B' ' 93' ' ' ALA . 20.3 m -122.51 141.01 44.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.748 -176.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.434 ' HA ' ' CB ' ' B' ' 67' ' ' SER . 0.3 OUTLIER -88.19 138.03 31.81 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.061 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.572 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.0 mm -107.59 120.92 45.87 Favored Pre-proline 0 C--N 1.317 -0.827 0 C-N-CA 120.634 -0.427 . . . . 0.0 109.887 -176.32 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.12 130.63 21.84 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.503 2.135 . . . . 0.0 112.469 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.9 t -89.67 131.84 35.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.645 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.444 ' HB ' ' CD2' ' B' ' 99' ' ' PHE . 47.6 t -97.48 111.22 26.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 172.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.493 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.5 mt-10 -92.64 107.19 19.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.629 0.728 . . . . 0.0 110.789 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.4 m -135.43 -174.33 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.299 -177.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.523 ' OD1' ' HB2' ' B' ' 103' ' ' LYS . 24.5 m-20 -105.61 -10.07 17.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.887 0.375 . . . . 0.0 110.547 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -165.19 156.28 14.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.687 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.481 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -84.77 156.2 61.45 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.702 0.287 . . . . 0.0 110.722 -179.1 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -54.88 170.55 0.61 Allowed 'Trans proline' 0 C--O 1.238 0.501 0 C-N-CA 123.464 2.776 . . . . 0.0 113.161 172.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.24 142.22 58.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.397 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.56 -9.7 66.7 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.24 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -88.11 147.1 25.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.274 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -101.38 102.89 13.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.434 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.481 ' HD2' HD22 ' A' ' 16' ' ' LEU . 14.5 ttt180 -104.67 143.92 32.42 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.049 -172.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.1 m . . . . . 0 C--O 1.251 1.136 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.276 176.454 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.479 0.649 0 CA-C-O 120.776 0.24 . . . . 0.0 111.754 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -142.44 45.25 1.63 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -92.55 -153.27 0.34 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.688 -170.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -71.5 174.11 7.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.08 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -76.9 157.42 31.39 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.741 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -108.78 -11.78 15.0 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.018 -177.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ASP . . . . . 0.401 ' HB2' ' HB2' ' B' ' 60' ' ' LYS . 5.3 p-10 -82.76 -4.56 58.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.979 -179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.5 t -55.85 112.58 4.46 Favored Pre-proline 0 C--N 1.329 -0.306 0 O-C-N 123.878 0.736 . . . . 0.0 112.178 -171.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.68 130.04 8.55 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.839 2.359 . . . . 0.0 111.64 174.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.575 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.1 tt0 -88.58 95.13 10.12 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.381 0.61 . . . . 0.0 109.766 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.6 m-85 -84.28 154.48 22.95 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.529 176.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -123.59 113.7 19.04 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -95.45 131.43 42.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.984 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.55 142.95 51.24 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.567 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -124.26 140.64 52.77 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.015 -0.274 . . . . 0.0 110.582 -176.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.9 tmtp? -145.3 133.82 22.0 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.704 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.473 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.92 137.49 34.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.713 179.366 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -117.54 150.67 38.58 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -125.27 111.17 14.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.958 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.59 54.52 6.62 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.584 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.81 171.45 14.48 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 174.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.78 66.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.687 0.756 . . . . 0.0 110.206 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.692 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -124.84 135.56 53.03 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.923 -178.756 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.511 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.5 mppt? -96.07 -23.53 16.75 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.619 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -136.66 130.3 31.97 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.735 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -118.63 123.46 45.04 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.836 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.619 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -120.04 130.85 73.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.73 119.95 38.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -123.74 103.48 12.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.517 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -108.86 153.7 23.15 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.693 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -100.52 114.43 28.05 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.501 -178.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.56 ' O ' ' HD3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -137.61 90.95 2.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.664 0.745 . . . . 0.0 111.318 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.575 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -137.65 153.27 74.0 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.63 177.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.525 ' HG2' ' ND2' ' B' ' 58' ' ' ASN . 37.4 Cg_endo -69.29 -3.84 12.51 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.859 2.373 . . . . 0.0 112.684 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' ASN . . . . . 0.525 ' ND2' ' HG2' ' B' ' 57' ' ' PRO . 0.2 OUTLIER -136.79 -81.55 0.38 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.635 179.164 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.549 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 11.3 p 50.87 113.22 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.615 1.166 . . . . 0.0 113.863 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.401 ' HB2' ' HB2' ' B' ' 30' ' ' ASP . 14.1 mmmm -120.11 74.59 21.25 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.113 179.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -66.69 145.49 75.78 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.71 2.273 . . . . 0.0 111.99 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -98.82 -61.86 1.31 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.019 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -164.48 172.81 12.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.827 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -117.12 116.2 26.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.727 0.298 . . . . 0.0 110.451 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 11.5 t -135.61 79.86 46.08 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.67 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 66.2 Cg_endo -87.9 160.43 7.47 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.068 2.512 . . . . 0.0 113.168 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' SER . . . . . 0.434 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 38.8 p -161.96 144.44 11.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.731 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.419 ' HB2' HD23 ' B' ' 75' ' ' LEU . 57.2 t80 -103.47 119.58 39.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.787 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -100.58 116.06 31.63 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.503 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.413 ' CD1' ' HG3' ' A' ' 4' ' ' MET . 47.2 m-85 -66.98 -24.91 66.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.891 -176.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.419 ' HB1' ' HD2' ' A' ' 2' ' ' PRO . . . -58.01 -43.26 86.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.708 -178.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.457 ' O ' HG13 ' B' ' 74' ' ' ILE . 10.3 mt-10 -112.45 4.76 17.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' ASN . . . . . 0.412 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.4 p-10 48.24 43.14 18.67 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 124.524 1.14 . . . . 0.0 111.067 -176.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.457 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.5 mt -119.25 134.67 62.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.269 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.419 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.5 tm? -102.92 103.34 13.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.431 ' HB2' ' HB3' ' B' ' 82' ' ' SER . 0.0 OUTLIER -88.8 144.91 25.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -178.173 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 77' ' ' ILE . . . . . 0.421 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 42.5 mm -98.51 -57.45 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.155 0.502 . . . . 0.0 110.927 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -147.07 179.06 7.89 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.22 4.76 10.72 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.286 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -93.86 -45.1 7.79 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -151.8 153.23 33.85 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.557 0.694 . . . . 0.0 112.452 -177.464 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' B' ' 76' ' ' TYR . 10.6 p -126.47 147.43 49.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.891 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 52.1 mm -106.83 109.12 62.93 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.936 0.398 . . . . 0.0 110.751 -177.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.416 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.9 Cg_endo -81.49 137.15 10.18 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.262 1.974 . . . . 0.0 112.024 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.91 150.18 36.83 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.949 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.463 ' HG2' HD12 ' B' ' 89' ' ' ILE . 28.6 Cg_endo -63.22 142.15 85.26 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.537 2.158 . . . . 0.0 111.552 176.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.412 ' NE ' HD21 ' B' ' 73' ' ' ASN . 10.0 mpt_? -79.19 -2.83 42.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.069 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.33 2.33 56.7 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.786 0.327 . . . . 0.0 111.083 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.463 HD12 ' HG2' ' B' ' 86' ' ' PRO . 58.1 mt -121.95 138.28 52.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.506 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.26 122.91 38.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 52.3 t -126.14 130.16 72.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.207 0.527 . . . . 0.0 111.299 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.2 OUTLIER -141.31 161.44 37.89 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.725 177.427 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.496 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -65.45 -12.6 54.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.201 -175.176 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.62 -9.23 47.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.213 0.53 . . . . 0.0 110.882 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.474 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 12.7 t70 -111.75 -24.82 9.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.673 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.3 mt -73.08 115.06 13.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.949 176.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.458 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.9 mmmm -111.35 101.92 10.35 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.949 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.572 HD12 ' HB ' ' A' ' 8' ' ' ILE . 32.8 mt -101.85 122.6 54.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 111.343 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.444 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 70.7 m-85 -133.21 118.13 18.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.252 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.493 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 20.2 t-80 -100.4 107.78 19.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.821 0.343 . . . . 0.0 110.495 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.63 HD12 ' CE1' ' B' ' 108' ' ' TYR . 49.8 mt -86.85 102.56 12.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.18 0.514 . . . . 0.0 110.021 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -17.34 63.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.658 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' LYS . . . . . 0.523 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 30.8 tttm -67.19 -48.91 66.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.998 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.606 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.4 mm-40 -101.32 4.93 42.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.159 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? 55.28 37.08 28.36 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.652 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 40.0 m -125.25 130.6 52.39 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.066 -174.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.54 117.69 33.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.629 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.63 ' CE1' HD12 ' B' ' 101' ' ' ILE . 10.1 m-85 -95.99 124.39 39.98 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.113 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.571 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.1 mm -114.81 115.92 50.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.869 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.505 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.3 m-85 -116.4 125.11 51.58 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 176.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.692 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 58.7 mt . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.94 -0.552 . . . . 0.0 109.741 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.62 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.72 120.5 8.35 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 122.542 2.161 . . . . 0.0 111.279 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' B' ' 71' ' ' ALA . 65.8 m80 -77.8 65.75 3.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.719 0.771 . . . . 0.0 111.094 -175.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 59.5 ttp -133.43 136.34 45.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.784 -1.098 . . . . 0.0 108.877 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 m -134.65 144.22 47.72 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.438 HG21 ' HB2' ' B' ' 93' ' ' ALA . 19.7 m -130.81 145.89 34.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.941 0.4 . . . . 0.0 110.891 -177.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 136.15 33.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.899 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.459 ' HB ' HD12 ' B' ' 98' ' ' ILE . 6.5 mm -105.19 121.08 47.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.309 -178.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.03 130.53 15.58 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.433 2.089 . . . . 0.0 112.26 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.409 HG13 HG22 ' B' ' 98' ' ' ILE . 46.4 t -86.95 133.3 30.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.576 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.511 HG12 HG13 ' A' ' 13' ' ' VAL . 98.9 t -98.01 119.94 46.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 173.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.415 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 28.8 mt-10 -93.18 111.99 23.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.566 0.698 . . . . 0.0 110.697 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.511 HG13 HG12 ' A' ' 11' ' ' VAL . 4.8 m -129.6 170.46 18.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.535 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -91.61 -20.24 21.86 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -168.76 155.9 7.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.12 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.446 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -78.7 149.32 74.3 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -67.56 172.23 10.71 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.328 2.019 . . . . 0.0 111.44 177.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.74 135.86 57.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.163 0.506 . . . . 0.0 111.439 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.0 -17.26 27.31 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.793 -175.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -94.06 146.73 23.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.939 0.4 . . . . 0.0 111.074 178.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -101.27 95.22 6.38 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.103 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HD2' HD22 ' A' ' 16' ' ' LEU . 18.3 ttt180 -90.84 146.48 23.9 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.841 -178.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.305 -0.855 . . . . 0.0 109.341 177.248 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.479 0.666 0 N-CA-C 110.547 -0.597 . . . . 0.0 110.547 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 42.4 m80 69.53 -52.91 0.61 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.578 0.751 . . . . 0.0 111.697 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -58.39 121.18 10.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.817 0.341 . . . . 0.0 110.568 178.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -131.17 147.35 52.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.683 176.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 27.2 mp0 -82.71 155.0 24.54 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.149 0.5 . . . . 0.0 110.772 -177.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.436 ' H ' ' CD ' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -103.14 -29.81 11.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.322 179.593 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -92.28 26.17 2.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.031 176.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.0 p -69.74 123.05 87.81 Favored Pre-proline 0 N--CA 1.448 -0.533 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.69 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' B' ' 59' ' ' SER . 20.0 Cg_endo -64.89 130.06 24.98 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.756 2.304 . . . . 0.0 112.598 -178.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.48 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 29.9 tt0 -104.03 102.85 12.61 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.541 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 92.5 m-85 -90.47 142.03 28.15 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.692 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.443 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 35.2 tt0 -112.4 107.15 15.84 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.57 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.6 p -94.91 127.26 47.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.261 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.443 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -124.26 121.44 35.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.407 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.572 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.5 ttt -107.65 139.11 42.7 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 -175.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.548 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 8.4 tmtm? -144.54 134.87 24.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.853 0.358 . . . . 0.0 110.515 -174.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.509 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -94.76 134.17 37.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -178.808 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.548 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 34.5 m-85 -119.15 139.4 51.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.985 0.422 . . . . 0.0 111.128 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -130.41 116.29 18.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.597 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 90.82 32.27 9.29 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.95 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.79 170.85 13.35 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.43 64.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.401 0.619 . . . . 0.0 110.448 177.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.566 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.3 p90 -126.97 147.58 50.11 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.795 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.509 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -104.57 -18.62 14.27 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.24 0.543 . . . . 0.0 109.742 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.629 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.83 133.34 31.9 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.398 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -119.77 131.12 55.26 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.629 HD11 HD12 ' B' ' 48' ' ' LEU . 1.9 mp -128.19 128.45 68.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.581 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.9 mm? -111.55 119.92 40.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.1 mp -126.88 104.07 12.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.541 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -111.43 153.76 25.65 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.942 0.401 . . . . 0.0 110.55 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.06 100.32 11.46 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.488 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.415 ' HD3' ' HB2' ' B' ' 35' ' ' GLU . 18.4 ptmt -129.28 93.5 3.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.6 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.612 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -134.83 158.2 75.5 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.106 176.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -60.68 -41.63 45.51 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.492 2.128 . . . . 0.0 110.559 172.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -138.56 97.43 3.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.073 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.612 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 11.9 p -134.32 134.3 41.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.512 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -128.13 77.28 76.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.887 177.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.75 144.88 67.26 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 122.421 2.081 . . . . 0.0 111.744 176.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -85.59 -63.85 1.25 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.19 -178.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -164.91 177.45 7.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.495 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' PHE . . . . . 0.404 ' CD1' HD12 ' B' ' 107' ' ' LEU . 72.9 m-85 -114.57 117.95 32.36 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.546 176.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.3 m -133.02 79.21 63.42 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 176.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -83.29 153.38 14.07 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.78 2.32 . . . . 0.0 112.436 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.2 m -156.65 145.95 20.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.213 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.448 ' HB2' HD23 ' B' ' 75' ' ' LEU . 49.8 t80 -108.34 124.42 50.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.599 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -105.28 116.71 32.41 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.646 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -66.7 -25.89 66.76 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.687 -176.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.429 ' HB2' ' HA ' ' A' ' 3' ' ' HIS . . . -54.8 -50.99 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.547 -178.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.9 mt-10 -112.68 7.56 18.71 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.486 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 50.66 42.73 27.51 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 124.268 0.98 . . . . 0.0 111.429 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 68.1 mt -117.75 138.07 49.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.457 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.448 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -105.03 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.49 140.17 29.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.7 mm -92.85 -57.06 4.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.958 -176.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' B' ' 80' ' ' LYS . 57.8 m-20 -151.95 -177.81 6.37 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -178.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.19 20.93 2.94 Favored Glycine 0 C--O 1.225 -0.409 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.964 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' LYS . . . . . 0.415 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.7 mmtt -110.62 -38.36 5.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -160.47 153.36 21.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.876 178.052 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.2 t -127.92 150.37 49.91 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.584 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mm -114.81 100.81 53.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.952 0.405 . . . . 0.0 111.045 -175.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.408 ' HA ' HG12 ' B' ' 74' ' ' ILE . 21.4 Cg_exo -67.92 136.55 38.67 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.712 2.275 . . . . 0.0 112.33 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 63.6 mt -103.65 153.82 38.37 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.092 -178.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.447 ' HG2' HD12 ' B' ' 89' ' ' ILE . 46.4 Cg_endo -72.33 138.69 30.63 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.125 1.883 . . . . 0.0 111.787 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 1.8 mmt180 -74.9 2.18 10.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.804 -177.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -86.91 -18.41 30.88 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.415 0.626 . . . . 0.0 110.053 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.447 HD12 ' HG2' ' B' ' 86' ' ' PRO . 66.7 mt -104.38 134.01 46.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.303 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 48.3 t -82.46 111.57 19.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.85 130.93 73.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.324 0.583 . . . . 0.0 111.461 -172.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.418 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.82 163.36 33.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.358 175.137 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.438 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.21 -19.01 64.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.913 0.387 . . . . 0.0 111.799 -177.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.3 -13.3 55.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.961 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 23.3 t0 -109.04 -20.69 12.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.573 0.701 . . . . 0.0 109.881 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.418 HG22 HG13 ' B' ' 98' ' ' ILE . 80.3 mt -76.73 116.27 19.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.786 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.5 mmmt -109.62 104.07 13.03 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.254 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.459 HD12 ' HB ' ' A' ' 8' ' ' ILE . 49.1 mt -107.82 121.38 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -130.71 121.12 24.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.257 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.415 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 30.1 t-80 -104.5 114.76 29.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.898 0.38 . . . . 0.0 110.597 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.518 HG22 ' H ' ' B' ' 104' ' ' GLU . 58.7 mt -90.96 100.55 11.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -69.69 -24.48 63.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.148 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -59.23 -47.92 83.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.321 0.581 . . . . 0.0 110.494 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.518 ' H ' HG22 ' B' ' 101' ' ' ILE . 13.7 mm-40 -100.88 0.79 39.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.819 -175.424 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 57.1 33.5 23.42 Favored 'General case' 0 N--CA 1.46 0.072 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.66 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.418 ' CG2' HD12 ' B' ' 51' ' ' LEU . 46.1 m -119.62 130.13 54.95 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -174.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 107' ' ' LEU . . . . . 0.406 HD21 ' CG2' ' B' ' 98' ' ' ILE . 0.5 OUTLIER -102.27 121.27 41.94 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.03 178.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.581 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.7 m-85 -98.97 126.79 44.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.155 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.511 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.3 mm -115.36 121.4 67.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.899 175.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 82.2 m-85 -122.55 124.32 43.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.566 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.819 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.901 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 112.178 -0.369 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -71.77 141.28 37.12 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.918 2.412 . . . . 0.0 111.523 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' B' ' 71' ' ' ALA . 2.2 p80 -102.13 54.61 0.8 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.397 0.618 . . . . 0.0 110.555 -177.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 54.9 tpp -55.65 124.68 18.18 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.088 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.3 p -147.46 135.37 21.23 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.406 -174.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -125.84 142.63 41.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.324 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.51 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -91.5 140.05 30.12 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.352 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.5 mm -110.35 123.52 35.67 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 -176.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -71.39 125.51 11.35 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.077 1.851 . . . . 0.0 111.979 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.486 HG23 HG22 ' B' ' 98' ' ' ILE . 1.9 p -97.65 119.96 46.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 13' ' ' VAL . 61.5 t -91.29 117.13 33.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -84.72 111.91 20.01 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.325 0.583 . . . . 0.0 110.271 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.559 HG13 HG12 ' A' ' 11' ' ' VAL . 3.3 m -124.55 -174.77 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.58 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -93.73 -26.77 16.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -171.14 167.19 7.16 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.344 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.494 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.3 mm? -71.04 143.49 88.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.636 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.92 174.48 11.15 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.928 2.419 . . . . 0.0 112.259 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.85 139.77 12.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.459 178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.16 -9.42 57.85 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.429 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -102.86 167.52 9.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.991 0.424 . . . . 0.0 111.953 -179.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -127.53 98.92 5.39 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.575 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' HB2' HD23 ' A' ' 16' ' ' LEU . 26.5 ttp85 -93.92 140.1 30.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.4 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.2 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.76 -0.638 . . . . 0.0 110.082 -177.024 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.471 0.178 0 N-CA-C 111.29 -0.311 . . . . 0.0 111.29 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -122.93 71.53 1.05 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.0 0.429 . . . . 0.0 110.534 177.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -140.34 147.61 40.09 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.893 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -77.91 145.43 36.16 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -142.11 162.43 35.5 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.327 0.584 . . . . 0.0 111.971 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -120.14 -15.32 8.72 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.977 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -86.11 -3.87 59.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.06 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.22 117.64 41.98 Favored Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.045 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -65.73 130.2 24.17 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.418 2.079 . . . . 0.0 112.061 -177.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.539 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.8 tt0 -97.18 100.02 11.5 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.255 0.55 . . . . 0.0 109.573 178.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 79.1 m-85 -85.76 145.16 27.37 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.029 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -123.47 112.75 17.88 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.634 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -100.83 131.39 48.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.694 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -120.81 150.51 40.91 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.581 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.3 ttt -135.63 134.49 39.31 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -176.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 10.2 tmtt? -142.83 132.55 23.94 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.996 -0.281 . . . . 0.0 110.527 -172.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.477 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.5 OUTLIER -95.01 133.01 39.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.132 0.492 . . . . 0.0 111.006 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.407 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 14.3 m-85 -111.85 140.33 46.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.012 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -118.4 121.97 41.64 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.275 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.01 46.54 43.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.638 -179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.09 170.94 14.26 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.49 -14.41 62.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.106 0.479 . . . . 0.0 110.768 178.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -134.82 137.69 43.56 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.611 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.531 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -96.32 -23.2 16.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.519 . . . . 0.0 109.841 -173.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.581 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.35 133.51 34.96 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.448 -176.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -119.31 122.46 41.92 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.569 ' CD1' HD12 ' B' ' 48' ' ' LEU . 2.4 mp -117.4 131.56 69.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.634 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 3.4 mm? -117.52 118.03 31.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 -176.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -122.71 103.74 13.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.9 pt-20 -110.42 153.41 25.03 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.371 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ASN . . . . . 0.42 ' OD1' ' HB3' ' B' ' 59' ' ' SER . 1.7 t-20 -102.12 108.82 20.36 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.365 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -134.01 92.84 3.01 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.651 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.539 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.71 160.93 64.59 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.663 175.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.418 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 17.8 Cg_endo -56.07 -44.57 45.61 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.698 2.265 . . . . 0.0 110.839 175.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -134.35 88.61 2.47 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.033 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.51 ' C ' ' HD2' ' B' ' 60' ' ' LYS . 4.2 m -95.5 111.58 23.46 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.749 -174.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.51 ' HD2' ' C ' ' B' ' 59' ' ' SER . 0.7 OUTLIER -122.13 75.7 40.75 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.503 178.212 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.56 151.65 47.49 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.011 2.474 . . . . 0.0 111.704 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -84.5 -52.62 6.01 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.025 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -169.55 -178.76 3.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.832 -177.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -127.31 108.03 10.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.975 170.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 50.6 m -138.3 79.97 29.43 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.449 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 71.9 Cg_endo -81.38 153.31 18.25 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.634 2.223 . . . . 0.0 113.102 -178.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' SER . . . . . 0.508 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 99.2 p -159.09 150.38 20.27 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.206 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.471 ' HB2' HD23 ' B' ' 75' ' ' LEU . 45.0 t80 -108.83 128.01 54.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.597 -177.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.568 ' O ' ' HA ' ' B' ' 73' ' ' ASN . 0.1 OUTLIER -108.2 128.11 54.43 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 176.512 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -75.1 -25.41 58.51 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.297 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.429 ' HB2' ' HA ' ' A' ' 3' ' ' HIS . . . -60.79 -51.45 69.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.816 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.52 ' O ' HD13 ' B' ' 74' ' ' ILE . 11.0 mm-40 -103.62 -10.6 18.28 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' ASN . . . . . 0.568 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 1.8 p-10 59.95 45.34 12.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.499 1.143 . . . . 0.0 110.183 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.52 HD13 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.7 143.8 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 113.914 -1.494 . . . . 0.0 109.099 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.471 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.2 tm? -110.27 97.83 7.21 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.1 OUTLIER -87.42 143.69 27.11 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.037 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 45.3 mm -95.84 -56.08 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.417 -171.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -160.46 24.0 0.15 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -174.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.1 -22.94 5.58 Favored Glycine 0 C--N 1.322 -0.246 0 C-N-CA 120.122 -1.037 . . . . 0.0 112.774 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -79.48 -28.61 41.48 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.451 HD21 ' CB ' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -162.45 153.54 17.63 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.325 175.031 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 63.5 p -124.3 150.61 45.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.571 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -106.93 100.14 30.15 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.809 0.338 . . . . 0.0 110.328 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.519 ' HA ' HD12 ' B' ' 74' ' ' ILE . 25.9 Cg_exo -65.91 131.5 27.44 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.686 2.257 . . . . 0.0 112.005 177.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 87.6 mt -101.72 151.37 37.89 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.261 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.35 143.24 31.15 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.647 2.231 . . . . 0.0 112.206 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -3.38 49.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.5 -178.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -82.44 -9.62 59.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 59.9 mt -118.88 136.49 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.429 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.7 p -87.55 115.11 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 48.1 t -123.06 136.18 60.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.095 0.474 . . . . 0.0 111.248 -174.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.597 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -140.48 164.54 29.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.965 178.396 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.16 -23.83 65.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.652 -176.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.67 -12.03 56.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.769 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.597 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 14.4 t0 -104.06 -24.64 13.19 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.787 0.803 . . . . 0.0 109.244 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.36 117.69 24.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.219 -179.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.6 mmmt -112.09 108.0 17.12 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.985 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.486 HG22 HG23 ' A' ' 10' ' ' VAL . 47.2 mt -111.63 118.26 57.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -132.45 121.83 24.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.269 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.516 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 38.4 t-80 -107.02 112.09 24.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.958 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.597 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.9 mp -85.18 108.35 16.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -76.12 -24.9 54.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.119 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.5 -46.5 89.73 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.597 ' H ' HG22 ' B' ' 101' ' ' ILE . 14.6 mt-10 -92.12 -2.2 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.28 0.562 . . . . 0.0 110.096 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 47.6 mtp180 54.23 38.91 30.21 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.287 -177.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.471 HG23 ' HB3' ' B' ' 53' ' ' GLU . 32.8 m -123.34 131.95 53.83 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.82 -172.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.73 114.89 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.454 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.616 ' CE2' HD11 ' B' ' 51' ' ' LEU . 48.6 m-85 -93.67 120.87 34.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.05 177.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.544 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.4 mm -110.88 123.85 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.974 177.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.443 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 84.7 m-85 -122.69 129.12 51.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 63.8 mt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.738 -0.649 . . . . 0.0 109.618 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 112.173 -0.371 . . . . 0.0 112.173 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.47 -22.75 71.2 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.872 2.381 . . . . 0.0 113.077 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -96.34 83.33 3.54 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 44.8 ttm -57.72 125.6 23.69 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 177.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 27.2 p -149.36 148.56 29.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.343 0.592 . . . . 0.0 112.316 -174.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.2 m -128.75 142.54 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.549 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.413 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -86.11 137.81 32.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 -177.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 mm -109.04 118.66 50.84 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.71 123.89 10.19 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.122 1.881 . . . . 0.0 111.849 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.5 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -96.14 127.92 47.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.773 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.514 HG12 HG13 ' A' ' 13' ' ' VAL . 58.6 t -92.12 128.21 43.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.71 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.436 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 39.5 mt-10 -97.49 109.11 21.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.328 0.585 . . . . 0.0 110.322 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.5 m -131.76 176.14 9.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.553 -177.216 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -101.2 -9.73 21.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.652 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -164.3 156.38 16.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.926 176.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.489 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -83.78 153.7 64.37 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.12 177.336 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -51.89 167.07 0.5 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.38 2.72 . . . . 0.0 113.318 173.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -72.3 130.54 41.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.99 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.6 29.91 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -173.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.28 153.05 18.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.071 0.462 . . . . 0.0 110.762 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -110.25 97.75 7.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.872 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.559 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 53.1 ttp85 -97.43 144.84 26.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.071 0.462 . . . . 0.0 111.683 -176.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.7 p . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.322 -0.854 . . . . 0.0 108.754 174.482 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo . . . . . 0 N--CA 1.475 0.433 0 N-CA-C 110.342 -0.676 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 55.2 48.97 18.28 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.822 0.82 . . . . 0.0 110.039 -175.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.95 27.81 4.22 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.629 -177.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -110.62 148.8 31.46 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.087 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -102.01 167.45 10.03 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.367 0.604 . . . . 0.0 111.012 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -95.35 -5.75 42.66 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.751 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ASP . . . . . 0.674 ' HA ' ' O ' ' B' ' 58' ' ' ASN . 9.9 m-20 -82.91 -14.06 54.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.643 175.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 95.0 t -60.33 116.57 18.32 Favored Pre-proline 0 N--CA 1.451 -0.401 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.153 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.52 129.06 24.0 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.395 2.064 . . . . 0.0 112.242 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.551 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.0 tt0 -106.76 99.51 9.07 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.126 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 90.4 m-85 -86.89 152.66 22.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.478 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -120.53 110.58 16.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.009 176.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 57.3 t -92.96 124.21 45.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.397 -178.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -121.57 137.92 54.53 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.107 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.526 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -120.43 139.83 52.26 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 -175.748 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.517 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.2 135.72 21.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.678 0.275 . . . . 0.0 110.295 -176.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.517 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -97.66 135.48 39.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 -178.128 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -118.26 147.53 43.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.458 177.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -133.72 119.8 19.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.065 0.459 . . . . 0.0 110.494 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.85 26.97 52.19 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.109 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.79 171.25 8.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.91 -13.98 60.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.133 0.492 . . . . 0.0 110.98 179.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.572 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -133.09 146.33 51.55 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 176.537 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.52 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -100.95 -22.26 14.84 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.23 0.538 . . . . 0.0 109.726 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.562 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.94 135.42 36.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.225 -178.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -120.46 129.16 53.75 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -123.16 131.65 72.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.63 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -115.14 117.13 29.67 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.2 102.9 13.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.493 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.9 pt-20 -109.05 153.32 23.81 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.896 0.379 . . . . 0.0 110.168 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.62 113.85 26.07 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.91 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.404 ' NZ ' ' HB2' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.02 93.23 3.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.368 0.604 . . . . 0.0 110.562 178.066 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.551 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -137.27 163.23 50.44 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.757 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 14.0 Cg_endo -57.12 -44.52 43.16 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.036 1.824 . . . . 0.0 111.416 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' ASN . . . . . 0.674 ' O ' ' HA ' ' B' ' 30' ' ' ASP . 15.1 m120 -137.74 68.22 1.41 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.888 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 12.0 p -61.53 115.46 3.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.433 0.635 . . . . 0.0 111.556 -175.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.41 ' HE3' ' HA ' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -126.15 73.01 71.71 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.782 177.707 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -70.99 147.18 54.39 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.357 2.038 . . . . 0.0 111.395 176.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -86.86 -54.16 4.51 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.839 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -166.92 175.98 7.31 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.597 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -125.49 111.37 14.99 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.473 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.0 t -131.96 78.17 70.22 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.536 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 81.6 Cg_endo -81.1 151.39 18.2 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.766 2.31 . . . . 0.0 113.621 -178.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 15.2 m -156.08 150.53 25.76 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.035 176.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.479 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 40.1 t80 -108.02 124.35 50.04 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.714 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.469 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.3 p30 -103.3 112.36 25.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.109 0.481 . . . . 0.0 110.55 176.079 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.61 -33.01 73.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.575 -177.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.64 -48.92 68.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.623 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.56 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.4 mt-10 -110.54 5.93 21.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.411 -176.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 48.51 43.16 19.82 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.397 1.06 . . . . 0.0 111.587 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.56 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.2 mt -118.15 143.32 29.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.555 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.426 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -109.32 101.81 10.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.536 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -88.6 142.81 27.39 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.826 -178.086 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 47.5 mm -96.05 -48.92 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.576 -177.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -165.71 -168.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.584 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.75 -4.94 59.7 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.007 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -86.5 -40.12 15.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.454 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -161.6 154.02 20.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.602 0.715 . . . . 0.0 112.675 -179.762 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.9 p -123.58 148.25 46.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.415 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.6 mm -105.23 105.21 51.06 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 120.621 0.248 . . . . 0.0 110.536 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.477 ' HA ' HG12 ' B' ' 74' ' ' ILE . 59.1 Cg_endo -74.85 131.58 14.64 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.138 1.892 . . . . 0.0 111.77 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 65.9 mt -99.79 154.08 37.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.031 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.43 139.91 46.57 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.335 2.023 . . . . 0.0 112.061 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.403 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 9.7 mpt_? -77.59 -6.85 55.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -84.76 -12.43 53.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.302 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.6 mt -113.96 133.83 58.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.986 -176.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.5 127.78 39.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.481 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 91' ' ' VAL . . . . . 0.479 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -137.35 138.91 44.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.259 0.552 . . . . 0.0 111.524 -174.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -140.33 166.38 24.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.044 178.951 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.09 -22.57 64.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.147 0.499 . . . . 0.0 111.572 -177.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.81 -9.75 55.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.114 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.408 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 31.0 t70 -107.08 -23.76 12.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.755 0.788 . . . . 0.0 109.688 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.407 HG22 HG13 ' B' ' 98' ' ' ILE . 76.9 mt -74.74 116.69 17.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.443 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.4 mmmm -111.34 105.36 13.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.894 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.5 HG22 HG23 ' A' ' 10' ' ' VAL . 56.3 mt -110.17 120.55 61.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.994 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.23 119.2 21.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.436 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.4 t-80 -97.14 108.03 20.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.675 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.555 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 46.8 mt -86.7 98.01 6.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 172.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -72.99 -20.59 60.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -58.15 -49.09 78.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.472 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.474 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.4 mm-40 -99.88 1.14 42.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.538 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 55.02 36.13 26.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.269 -175.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.493 HG23 ' HB3' ' B' ' 53' ' ' GLU . 22.7 m -116.73 126.4 53.1 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.35 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 54.3 tp -101.28 121.72 42.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.662 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.63 ' CE2' HD11 ' B' ' 51' ' ' LEU . 21.2 m-85 -101.97 128.29 48.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.384 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.6 mm -116.3 122.0 68.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.66 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.49 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 86.0 m-85 -122.44 126.35 47.74 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.572 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--N 1.319 -0.752 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.715 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.677 0 N-CA-C 111.812 -0.515 . . . . 0.0 111.812 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.06 164.41 22.37 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.839 2.36 . . . . 0.0 112.208 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -124.53 63.28 1.11 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.331 0.586 . . . . 0.0 109.566 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 83.0 mtp -81.96 137.41 35.15 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.798 -176.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 28.5 p -158.68 127.13 5.31 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.014 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.4 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.3 m -124.22 140.73 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.068 0.461 . . . . 0.0 110.642 -178.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 135.1 35.03 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.157 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.4 mm -112.07 114.18 51.47 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -71.5 135.81 27.19 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 121.869 1.712 . . . . 0.0 111.08 175.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.496 HG23 HG22 ' B' ' 98' ' ' ILE . 1.4 p -100.41 128.59 52.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.748 -177.343 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.506 HG12 HG13 ' A' ' 13' ' ' VAL . 47.6 t -87.26 112.68 23.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.766 179.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.7 mt-10 -92.13 106.76 18.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.444 0.64 . . . . 0.0 110.223 179.188 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.506 HG13 HG12 ' A' ' 11' ' ' VAL . 2.2 m -129.21 -172.57 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.084 -175.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -96.87 -30.22 13.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.143 0.497 . . . . 0.0 109.661 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -149.66 166.05 30.51 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.233 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.8 mm? -80.05 141.47 54.5 Favored Pre-proline 0 C--N 1.316 -0.874 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.198 173.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.71 166.47 0.23 Allowed 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 123.485 2.79 . . . . 0.0 113.029 172.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -68.56 132.34 46.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.578 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.1 -2.17 29.91 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.638 -174.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -102.46 175.18 5.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.996 0.427 . . . . 0.0 111.142 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.59 112.33 12.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.707 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.494 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.5 ttp85 -118.75 147.75 43.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.3 m . . . . . 0 C--O 1.244 0.792 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.869 179.48 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo . . . . . 0 N--CA 1.473 0.291 0 N-CA-C 110.422 -0.645 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -89.63 80.52 6.62 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.4 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 60.29 -160.69 0.29 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.636 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -72.86 177.0 5.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.434 0.635 . . . . 0.0 111.227 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' GLN . . . . . 0.416 ' HB2' HG23 ' B' ' 31' ' ' VAL . 54.4 mt-30 -110.42 159.15 17.74 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.766 -178.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -75.81 -15.19 60.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.317 -175.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -88.37 -4.03 58.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.533 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' B' ' 28' ' ' GLN . 49.0 t -79.59 114.1 42.76 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.721 -178.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -72.33 133.98 21.94 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 122.639 2.226 . . . . 0.0 112.257 177.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -108.21 100.07 9.42 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.453 ' HB2' HD21 ' B' ' 81' ' ' LEU . 96.1 m-85 -90.5 154.92 19.27 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.372 -178.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -120.0 108.9 14.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.068 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 92.1 t -91.11 129.36 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.008 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -127.07 142.75 51.45 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 176.791 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.559 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.3 ttt -123.97 141.21 52.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.637 -175.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.9 tmtt? -140.92 133.47 28.57 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.562 -176.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.46 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 9.2 mpt_? -99.34 138.73 36.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.995 0.426 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.404 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 53.8 m-85 -118.77 167.32 11.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.448 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.31 105.23 4.02 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.013 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.84 46.96 6.9 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.891 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.98 172.19 12.96 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 -25.27 64.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.554 0.692 . . . . 0.0 110.492 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.571 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -131.8 141.95 49.6 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.684 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.501 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.05 -21.42 15.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.266 0.555 . . . . 0.0 109.679 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.608 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.66 135.29 33.09 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.781 -178.469 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -124.51 133.6 53.28 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.608 HD11 HD12 ' B' ' 48' ' ' LEU . 2.4 mp -125.45 132.37 71.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.474 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.4 mm? -113.55 121.99 45.89 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.3 103.13 11.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 177.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.42 ' HB3' HG23 ' B' ' 106' ' ' THR . 14.0 pt-20 -114.99 153.41 30.67 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.106 0.479 . . . . 0.0 110.305 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -95.94 110.2 22.45 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.423 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -130.04 94.11 3.64 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.868 0.842 . . . . 0.0 110.536 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.548 ' HB3' ' HB2' ' B' ' 59' ' ' SER . . . -133.84 157.8 76.96 Favored Pre-proline 0 C--N 1.311 -1.084 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.515 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.03 -22.95 76.36 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.982 2.455 . . . . 0.0 111.531 174.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -139.64 -91.02 0.18 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.324 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.548 ' HB2' ' HB3' ' B' ' 56' ' ' ALA . 44.1 t 70.01 138.93 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 122.031 0.919 . . . . 0.0 111.97 178.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -137.66 79.11 35.49 Favored Pre-proline 0 C--N 1.313 -0.996 0 CA-C-N 114.663 -1.153 . . . . 0.0 108.786 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -60.87 137.02 69.8 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.081 2.521 . . . . 0.0 112.634 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' ASP . . . . . 0.494 ' OD2' ' HG2' ' B' ' 63' ' ' ARG . 22.2 t70 -81.79 -74.14 0.35 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.656 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.494 ' HG2' ' OD2' ' B' ' 62' ' ' ASP . 20.1 ptt180 -166.87 175.29 7.83 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 175.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -115.16 116.0 27.66 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -136.92 79.64 38.34 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-O 121.096 0.474 . . . . 0.0 109.782 175.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -80.03 158.38 23.83 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.982 2.455 . . . . 0.0 113.486 -178.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 90.8 p -158.56 147.89 19.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.074 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.441 ' HB2' HD23 ' B' ' 75' ' ' LEU . 53.8 t80 -106.95 117.97 35.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.196 0.522 . . . . 0.0 110.847 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.486 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.7 OUTLIER -100.02 110.18 22.5 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.526 176.539 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -60.52 -33.58 72.85 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.66 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -51.79 -44.14 63.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.719 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.446 ' O ' HG13 ' B' ' 74' ' ' ILE . 4.1 mm-40 -111.56 4.0 18.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.46 44.9 17.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.422 -176.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.446 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.6 mt -121.74 135.05 63.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.163 -178.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.441 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -100.84 100.85 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.0 OUTLIER -84.83 144.63 28.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -177.757 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.8 mm -98.41 -59.57 3.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.299 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -144.88 -178.04 5.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.419 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.98 3.61 27.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.749 176.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -90.21 -40.56 12.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.505 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.4 pp -160.22 153.29 21.68 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.624 -0.717 . . . . 0.0 112.224 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 23.9 p -121.07 147.56 45.36 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.65 174.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.0 mm -102.71 103.99 36.02 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.852 0.358 . . . . 0.0 110.344 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.432 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.3 Cg_endo -81.88 130.38 6.62 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.281 1.988 . . . . 0.0 112.599 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -96.86 147.2 32.57 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.955 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.465 ' HG2' HD12 ' B' ' 89' ' ' ILE . 31.2 Cg_endo -65.36 140.65 64.77 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.199 1.932 . . . . 0.0 111.343 175.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.4 ' NH1' ' HA ' ' B' ' 86' ' ' PRO . 0.1 OUTLIER -73.14 -5.74 41.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.429 -175.851 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -81.5 -11.57 59.15 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.311 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.465 HD12 ' HG2' ' B' ' 86' ' ' PRO . 58.8 mt -114.84 136.64 50.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.902 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.1 p -84.51 113.41 23.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.215 0.531 . . . . 0.0 109.971 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 62.1 t -120.49 130.72 74.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-O 121.122 0.487 . . . . 0.0 111.128 -175.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.403 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.43 164.43 30.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.912 177.962 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.4 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.22 -18.01 63.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.871 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.4 -14.82 48.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.831 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.403 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 20.4 t70 -108.67 -23.98 11.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.837 -175.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.442 HG22 HG13 ' B' ' 98' ' ' ILE . 80.5 mt -73.45 115.33 14.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.18 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -110.09 98.82 8.01 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.575 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.496 HG22 HG23 ' A' ' 10' ' ' VAL . 39.2 mt -99.84 116.72 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.005 0.431 . . . . 0.0 110.766 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -130.66 121.34 25.38 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.095 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.453 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 27.8 t-80 -109.54 125.29 52.35 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.047 0.451 . . . . 0.0 110.882 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.54 HG22 ' H ' ' B' ' 104' ' ' GLU . 85.4 mt -104.12 113.02 39.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.973 177.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.51 -23.38 61.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.709 0.29 . . . . 0.0 110.573 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.54 ' H ' HG22 ' B' ' 101' ' ' ILE . 42.7 mt-10 -95.23 0.67 54.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.135 0.493 . . . . 0.0 109.985 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 51.71 37.29 19.79 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.207 -173.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.42 HG23 ' HB3' ' B' ' 53' ' ' GLU . 62.4 m -121.52 133.98 55.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.535 -173.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 107' ' ' LEU . . . . . 0.448 ' HG ' ' CD2' ' B' ' 100' ' ' HIS . 0.4 OUTLIER -100.33 118.16 36.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.964 177.9 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.515 ' HB3' ' CE1' ' B' ' 110' ' ' TYR . 29.8 m-85 -98.12 119.05 36.09 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.9 179.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.492 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.3 mm -108.99 123.0 64.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.843 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 67.7 m-85 -122.53 126.64 48.21 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.571 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.776 -0.631 . . . . 0.0 109.775 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.725 0 N-CA-C 111.749 -0.54 . . . . 0.0 111.749 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.43 81.82 0.71 Allowed 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.057 2.505 . . . . 0.0 113.118 -175.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.489 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 46.7 t60 175.33 -54.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.4 ' SD ' HG13 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 176.48 135.33 0.06 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.917 -1.038 . . . . 0.0 108.877 179.365 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 13.4 p -145.24 126.05 14.36 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.809 0.338 . . . . 0.0 110.589 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.4 HG13 ' SD ' ' A' ' 4' ' ' MET . 15.3 m -114.79 140.86 33.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.203 -177.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.417 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.4 OUTLIER -86.11 139.11 31.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.098 -179.865 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.547 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.0 mm -111.36 117.2 49.83 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.362 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -71.24 129.68 16.4 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.321 2.014 . . . . 0.0 112.428 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.07 137.07 21.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.406 HG12 HG13 ' A' ' 13' ' ' VAL . 67.6 t -101.15 112.95 35.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.56 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.0 mt-10 -94.98 107.88 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.418 0.628 . . . . 0.0 110.754 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.406 HG13 HG12 ' A' ' 11' ' ' VAL . 2.7 m -127.84 -173.27 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.631 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.47 -33.57 36.57 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -175.46 175.78 2.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.741 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.453 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.9 mm? -78.17 140.66 61.6 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-O 120.772 0.32 . . . . 0.0 110.844 -177.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.97 173.65 9.95 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.81 2.34 . . . . 0.0 111.738 174.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -56.82 139.4 51.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.014 0.435 . . . . 0.0 110.952 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.04 -22.48 23.14 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.647 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.422 ' HB2' ' HB3' ' A' ' 16' ' ' LEU . 66.7 m-85 -93.7 166.55 12.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.441 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -124.9 99.49 6.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.386 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.521 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 57.9 ttp85 -97.08 147.57 23.9 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.681 -178.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.8 m . . . . . 0 C--O 1.251 1.18 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.302 178.786 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo . . . . . 0 N--CA 1.482 0.817 0 N-CA-C 110.511 -0.611 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -119.99 123.71 44.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.751 0.31 . . . . 0.0 110.942 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -87.8 99.35 12.04 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 174.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -85.56 145.39 27.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.064 -177.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -112.19 177.96 4.47 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.648 0.737 . . . . 0.0 111.152 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -120.98 -4.06 9.6 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.93 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -88.4 -8.69 54.6 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.881 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.53 114.5 13.35 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.328 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.54 130.0 11.42 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.716 2.278 . . . . 0.0 112.361 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.411 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 35.0 tt0 -92.48 100.33 12.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 175.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.481 ' HB2' HD21 ' B' ' 81' ' ' LEU . 68.0 m-85 -87.19 153.88 21.16 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.417 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -132.87 116.59 16.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.558 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.7 p -102.27 132.3 48.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.01 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.61 151.35 44.94 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.701 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.0 OUTLIER -128.55 137.46 51.75 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -177.323 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.418 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 2.5 tmtp? -143.68 132.37 22.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.611 0.244 . . . . 0.0 110.413 -174.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.418 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.3 OUTLIER -95.65 141.4 29.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.335 -177.018 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -121.13 147.12 46.01 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -119.43 118.54 31.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.941 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.23 51.77 46.81 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.562 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.9 171.7 13.58 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.57 -16.95 62.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.251 0.548 . . . . 0.0 110.74 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.614 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -133.53 144.18 49.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.916 176.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.512 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.7 mppt? -98.87 -23.53 15.32 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -178.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.701 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -137.63 134.94 36.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.222 -179.125 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -120.18 117.89 29.07 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -111.91 130.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.558 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.1 mm? -112.62 112.85 24.68 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.375 -176.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.16 103.38 14.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.527 ' HB3' HG23 ' B' ' 106' ' ' THR . 10.3 pt-20 -113.28 150.31 32.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.026 0.441 . . . . 0.0 110.68 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -94.93 113.7 25.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.021 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 ptmm? -137.26 93.03 2.77 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.492 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.502 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -132.63 162.09 59.39 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.577 175.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -60.7 -41.71 44.75 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.375 2.05 . . . . 0.0 110.454 171.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -142.48 99.29 3.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.718 -1.128 . . . . 0.0 109.194 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.502 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 5.5 p -133.03 138.22 46.72 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.616 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.506 ' HA ' ' HE2' ' B' ' 60' ' ' LYS . 6.6 mmpt? -131.87 75.0 76.52 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.478 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -77.71 138.25 16.84 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.201 1.934 . . . . 0.0 111.469 172.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -108.04 -49.12 3.26 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.926 -177.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 22.8 ptt180 -157.94 176.45 12.53 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.421 -175.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -133.03 143.87 49.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.523 -178.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 p -133.45 78.74 62.14 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.459 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 86.3 Cg_endo -83.81 152.93 13.12 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.679 2.253 . . . . 0.0 112.158 179.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 67' ' ' SER . . . . . 0.491 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.9 m -156.03 141.63 17.8 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.184 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.433 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 51.0 t80 -99.52 129.41 45.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.326 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.577 HD21 ' HB2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -108.28 131.09 55.07 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.562 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -79.02 -24.28 43.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.332 -178.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.489 ' HB2' ' HB3' ' A' ' 3' ' ' HIS . . . -62.96 -51.71 65.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.476 . . . . 0.0 110.988 -176.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.577 ' HB2' HD21 ' B' ' 69' ' ' ASN . 3.6 mt-10 -104.86 -2.34 24.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.284 178.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 58.94 39.62 23.47 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.171 0.986 . . . . 0.0 110.229 174.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.577 HG13 ' O ' ' B' ' 72' ' ' GLU . 86.2 mt -118.67 136.3 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 114.447 -1.252 . . . . 0.0 111.131 -177.001 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.405 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.9 tm? -100.1 100.52 11.39 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.491 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -87.68 141.18 28.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.587 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.8 mm -90.94 -49.64 13.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.89 -175.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.2 m-20 -157.92 -170.54 3.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.39 21.19 5.35 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.398 178.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -107.07 -47.17 3.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.31 0.576 . . . . 0.0 110.038 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -151.1 153.08 34.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.296 -178.843 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 24.1 p -126.97 145.51 50.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.951 178.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.5 102.75 39.43 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-O 120.817 0.341 . . . . 0.0 110.66 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.464 ' HA ' HG12 ' B' ' 74' ' ' ILE . 74.1 Cg_endo -78.74 134.59 12.21 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.157 1.905 . . . . 0.0 112.3 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -98.49 153.27 38.06 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.464 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.436 ' HG2' HD12 ' B' ' 89' ' ' ILE . 37.1 Cg_endo -66.59 140.61 57.48 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.488 2.126 . . . . 0.0 111.322 175.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.61 -8.66 57.33 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.211 -176.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.75 -13.35 59.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.282 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.436 HD12 ' HG2' ' B' ' 86' ' ' PRO . 57.7 mt -114.15 135.15 54.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.895 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 90.7 t -86.79 114.47 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' VAL . . . . . 0.433 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.0 p -123.44 134.85 65.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.329 0.585 . . . . 0.0 111.325 -175.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.06 166.43 24.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.546 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.6 -12.26 60.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.749 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.63 -9.87 48.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.37 0.605 . . . . 0.0 110.637 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -111.39 -24.1 10.39 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.766 -178.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.406 HG22 HG13 ' B' ' 98' ' ' ILE . 82.4 mt -73.73 120.1 22.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.284 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.452 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -113.82 103.05 10.81 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.69 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.547 HD12 ' HB ' ' A' ' 8' ' ' ILE . 37.5 mt -105.75 120.98 57.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.98 0.419 . . . . 0.0 111.439 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -132.85 121.25 22.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.472 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.56 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 15.5 t-80 -105.24 117.9 35.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.42 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.702 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.3 mp -91.49 125.34 44.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 102' ' ' ARG . . . . . 0.445 ' HD3' ' OE2' ' A' ' 12' ' ' GLU . 12.1 mmm180 -76.22 -42.61 45.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.465 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 103' ' ' LYS . . . . . 0.417 ' HE3' ' HB2' ' B' ' 103' ' ' LYS . 36.0 ttmt -59.53 -47.82 84.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.681 -175.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.702 ' H ' HG22 ' B' ' 101' ' ' ILE . 16.0 mm-40 -87.47 -3.94 59.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.859 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 53.54 38.97 29.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.858 -175.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.527 HG23 ' HB3' ' B' ' 53' ' ' GLU . 59.6 m -125.92 137.87 53.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.93 0.395 . . . . 0.0 111.097 -172.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 107' ' ' LEU . . . . . 0.487 HD13 ' HB2' ' B' ' 100' ' ' HIS . 27.5 tp -109.23 119.72 40.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.181 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.564 ' CE1' HD13 ' B' ' 101' ' ' ILE . 47.4 m-85 -102.11 129.16 48.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.2 mm -115.39 118.43 58.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.808 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.7 m-85 -117.18 125.7 51.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.614 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.2 mt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.655 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.717 0 N-CA-C 112.087 -0.405 . . . . 0.0 112.087 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.69 119.84 7.24 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.795 2.33 . . . . 0.0 111.895 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.501 ' HA ' ' HB2' ' B' ' 71' ' ' ALA . 42.9 m80 -90.39 64.32 5.89 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.841 -177.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 48.1 ttm -93.86 129.79 40.14 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.338 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.444 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 33.1 p -135.46 127.28 29.31 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.064 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -117.45 143.01 29.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.752 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.442 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -87.82 137.47 32.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.308 -178.074 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.451 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.3 mm -109.78 114.94 56.12 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.31 128.69 14.01 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.292 1.995 . . . . 0.0 112.269 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.52 132.67 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.111 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.467 HG12 HG13 ' A' ' 13' ' ' VAL . 79.4 t -94.72 114.55 31.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 174.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.487 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 23.0 mt-10 -91.1 111.2 22.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.549 0.69 . . . . 0.0 110.811 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.467 HG13 HG12 ' A' ' 11' ' ' VAL . 2.6 m -127.55 179.26 3.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.513 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -89.84 -28.05 19.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.147 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -169.64 164.14 10.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.977 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.516 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -78.92 143.72 62.47 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 120.692 0.282 . . . . 0.0 110.331 -178.351 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -71.35 175.04 9.92 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.917 2.412 . . . . 0.0 112.44 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.94 138.57 11.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.707 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.1 -5.09 61.09 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.166 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -106.49 149.23 27.3 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.172 0.51 . . . . 0.0 111.653 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -110.68 98.09 7.34 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.245 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.516 ' HD2' HD22 ' A' ' 16' ' ' LEU . 10.0 ttt180 -80.21 143.86 33.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.181 -178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 t . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.373 -0.822 . . . . 0.0 110.238 -176.514 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.476 0.486 0 N-CA-C 109.996 -0.809 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 7.2 t-160 -66.9 -54.86 18.0 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 62.12 102.29 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.72 0.637 . . . . 0.0 111.373 176.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -76.47 158.91 30.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.448 0.642 . . . . 0.0 111.309 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -97.56 154.38 17.56 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.326 -177.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -94.45 -14.38 25.26 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.631 -172.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ASP . . . . . 0.56 ' OD2' ' HE3' ' B' ' 60' ' ' LYS . 7.2 p-10 -83.36 -13.43 54.99 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.814 177.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 63.8 t -68.41 119.71 70.03 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.441 177.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.458 ' HA ' ' CB ' ' B' ' 59' ' ' SER . 36.6 Cg_endo -69.37 129.73 18.55 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.346 2.03 . . . . 0.0 111.723 177.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.512 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 32.8 tt0 -105.74 99.19 8.8 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.488 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.461 ' HB2' HD21 ' B' ' 81' ' ' LEU . 81.3 m-85 -87.06 137.77 32.06 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.498 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.522 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 36.1 tt0 -110.19 113.7 26.59 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.04 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 96.8 t -93.98 124.06 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.917 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -118.58 131.76 56.2 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.22 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.652 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -118.91 135.78 54.4 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -176.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.492 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 5.3 tmtm? -142.57 131.65 23.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.869 0.366 . . . . 0.0 110.775 -173.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.492 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -90.5 132.04 35.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.927 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -116.69 149.01 40.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.904 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -132.29 122.62 25.42 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.547 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.03 23.85 58.65 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.307 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -113.28 170.8 7.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.79 -11.01 60.53 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 177.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.59 142.05 43.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.568 177.102 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.493 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.29 -19.69 18.38 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.148 0.499 . . . . 0.0 109.752 -175.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.652 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -135.83 132.76 37.06 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.65 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -115.93 122.02 44.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.202 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.607 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -121.41 128.95 75.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.555 HD11 ' CD2' ' B' ' 108' ' ' TYR . 3.7 mm? -114.83 120.61 40.6 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -122.12 103.56 13.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -113.06 153.49 28.05 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.147 0.499 . . . . 0.0 110.312 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -99.51 111.33 23.7 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.343 -176.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' B' ' 55' ' ' LYS . 7.6 ptmm? -134.7 92.19 2.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.182 0.515 . . . . 0.0 110.837 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.788 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -137.34 162.05 57.38 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.276 176.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.6 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 10.1 Cg_endo -49.5 -43.91 37.01 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.3 2.667 . . . . 0.0 112.176 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -130.76 -67.28 0.72 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.996 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.788 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 53.3 p 58.37 131.14 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 173.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.56 ' HE3' ' OD2' ' B' ' 30' ' ' ASP . 21.6 pttp -120.6 83.15 34.39 Favored Pre-proline 0 N--CA 1.446 -0.651 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.755 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -59.47 140.31 93.51 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.693 2.262 . . . . 0.0 111.728 176.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -90.08 -76.15 0.43 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.706 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -159.31 176.33 12.29 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.185 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -126.36 108.97 11.73 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.14 0.495 . . . . 0.0 110.539 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.4 t -134.66 79.63 52.58 Favored Pre-proline 0 C--N 1.317 -0.812 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.039 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.08 158.18 13.36 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.813 2.342 . . . . 0.0 112.019 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.3 m -158.1 144.57 17.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.038 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.437 ' HB2' HD23 ' B' ' 75' ' ' LEU . 72.2 t80 -104.34 128.95 52.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.358 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.476 ' OD1' ' HB3' ' B' ' 71' ' ' ALA . 0.1 OUTLIER -109.69 125.33 52.52 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.632 178.311 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -75.72 -24.82 56.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.444 -175.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.501 ' HB2' ' HA ' ' A' ' 3' ' ' HIS . . . -62.28 -42.0 98.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.492 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.524 ' O ' HD13 ' B' ' 74' ' ' ILE . 12.6 mt-10 -112.96 -7.81 13.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.291 178.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 60.52 42.35 14.36 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 124.644 1.215 . . . . 0.0 110.38 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.524 HD13 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.67 138.51 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.008 178.266 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.8 tm? -106.33 99.86 9.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.12 144.66 27.4 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.7 mm -105.25 -49.37 9.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.076 0.465 . . . . 0.0 111.193 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.65 174.31 11.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -175.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.82 4.75 28.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.437 -0.887 . . . . 0.0 111.255 174.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 30.2 mttp -101.43 -34.57 9.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.906 -0.647 . . . . 0.0 110.424 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.5 OUTLIER -157.62 152.51 25.48 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.56 0.695 . . . . 0.0 111.989 -177.173 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 28.4 p -133.3 143.61 49.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.805 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.5 mm -101.76 106.48 47.1 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.475 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.497 ' HA ' HD12 ' B' ' 74' ' ' ILE . 73.4 Cg_endo -82.1 135.12 8.42 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.135 1.89 . . . . 0.0 112.343 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.59 149.05 35.54 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.55 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.425 ' HG2' HD12 ' B' ' 89' ' ' ILE . 32.5 Cg_endo -68.34 142.47 54.88 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.148 1.899 . . . . 0.0 111.337 175.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.462 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 8.9 mpt_? -78.74 -0.06 28.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.682 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -81.78 -15.61 53.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.043 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.425 HD12 ' HG2' ' B' ' 86' ' ' PRO . 51.5 mt -109.98 134.12 53.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.979 -176.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.96 114.38 25.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.64 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 51.4 t -120.6 135.5 60.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.303 0.573 . . . . 0.0 111.246 -173.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.07 161.15 38.54 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.708 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.72 64.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.799 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.62 -16.03 49.91 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.061 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -104.05 -22.21 13.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.603 0.715 . . . . 0.0 109.706 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.2 mt -73.99 119.28 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.276 178.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -113.14 108.86 17.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.856 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.451 HD12 ' HB ' ' A' ' 8' ' ' ILE . 55.5 mt -113.33 119.5 60.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.885 0.374 . . . . 0.0 111.296 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -128.56 117.7 21.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -178.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.487 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 32.3 t-80 -100.08 121.18 41.0 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.687 HG22 ' H ' ' B' ' 104' ' ' GLU . 70.5 mt -102.84 104.84 17.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 173.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -79.05 -18.05 54.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.186 -176.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.93 -44.33 85.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.424 0.631 . . . . 0.0 109.995 174.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.687 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.8 tp10 -94.24 -4.42 48.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.083 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 57.1 35.1 25.88 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.738 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.416 HG23 ' HB3' ' B' ' 53' ' ' GLU . 61.4 m -126.65 137.3 53.28 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.851 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.4 tp -106.52 125.31 50.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.277 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.603 ' CE1' HD12 ' B' ' 101' ' ' ILE . 21.6 m-85 -105.82 126.14 51.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.835 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.607 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.0 mm -116.48 124.92 73.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.027 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.415 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.2 m-85 -126.63 126.79 44.17 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.527 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.5 mt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.006 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.0 124.2 13.15 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.842 2.362 . . . . 0.0 111.844 178.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' B' ' 70' ' ' PHE . 33.6 m170 -78.81 49.05 0.87 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.746 -178.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 64.96 175.55 0.2 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-O 122.027 0.918 . . . . 0.0 113.028 176.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 p -152.07 129.22 11.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.323 177.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.3 m -112.39 142.81 23.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.91 0.386 . . . . 0.0 110.875 -176.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.419 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -86.82 137.66 32.23 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.24 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.0 mm -109.11 121.79 41.74 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.874 -0.331 . . . . 0.0 110.272 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.2 127.83 14.78 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.368 2.045 . . . . 0.0 112.226 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.458 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -101.94 130.94 50.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.449 HG12 HG13 ' A' ' 13' ' ' VAL . 50.7 t -97.35 121.65 48.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.923 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.531 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 44.4 mt-10 -95.49 106.28 18.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.186 0.517 . . . . 0.0 110.799 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.535 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 3.6 m -128.79 -175.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.979 -177.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -99.46 -23.07 15.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.248 0.547 . . . . 0.0 109.879 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.73 156.3 36.11 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.87 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.91 146.09 48.25 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -69.24 173.66 10.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.553 2.168 . . . . 0.0 112.15 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -52.02 140.09 21.22 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.966 -177.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.34 -20.32 42.9 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.057 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -89.79 147.37 23.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.07 0.462 . . . . 0.0 111.509 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -108.02 106.47 16.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.477 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -117.88 151.45 37.36 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.501 177.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.044 -176.87 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.371 0 N-CA-C 110.057 -0.786 . . . . 0.0 110.057 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 49.0 m80 58.02 55.7 5.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.455 0.645 . . . . 0.0 110.838 -177.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.11 148.72 46.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.293 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -97.0 175.16 6.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.201 0.524 . . . . 0.0 111.352 -177.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' GLN . . . . . 0.517 ' HB2' HG23 ' B' ' 31' ' ' VAL . 24.9 mt-30 -144.38 155.37 43.75 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.194 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.48 ' O ' ' HB2' ' B' ' 58' ' ' ASN . 10.1 pt-20 -74.03 -20.58 60.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.747 -173.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -89.56 -4.35 57.9 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.326 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.517 HG23 ' HB2' ' B' ' 28' ' ' GLN . 21.6 t -79.32 116.77 62.9 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.309 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.635 ' HB3' HD22 ' B' ' 54' ' ' ASN . 20.7 Cg_endo -65.4 128.94 21.37 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.145 1.896 . . . . 0.0 111.571 178.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.564 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 33.9 tt0 -108.46 101.51 10.68 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.509 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 84.7 m-85 -81.87 148.36 28.84 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -124.35 115.32 20.81 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.595 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.6 p -102.41 134.86 41.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.94 -173.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.426 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -126.19 147.23 49.69 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.182 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.618 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -121.85 135.88 54.91 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.618 -178.464 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.506 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 4.9 tmtm? -137.05 131.94 33.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.336 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.423 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.6 OUTLIER -95.23 137.23 34.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.857 0.36 . . . . 0.0 111.101 -179.504 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.506 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 39.5 m-85 -119.62 160.5 22.37 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.733 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -143.08 121.55 12.41 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 76.8 29.58 57.24 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.447 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.03 171.73 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.44 -12.77 55.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.172 0.511 . . . . 0.0 110.485 177.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.539 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -137.75 146.55 43.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.862 177.837 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.502 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.58 -21.52 15.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.247 0.546 . . . . 0.0 109.609 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.618 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.03 136.99 38.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.352 -178.885 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -124.38 121.6 35.38 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.599 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -113.73 129.86 68.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.595 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 4.4 mm? -112.36 115.09 28.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.136 -177.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.0 103.56 14.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -109.48 153.31 24.24 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.475 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ASN . . . . . 0.635 HD22 ' HB3' ' B' ' 32' ' ' PRO . 39.3 t-20 -94.74 114.44 26.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.994 -178.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -137.94 92.18 2.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.282 0.563 . . . . 0.0 110.89 176.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.736 ' HB3' ' OG ' ' B' ' 59' ' ' SER . . . -136.43 167.39 21.78 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 174.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.616 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 3.3 Cg_endo -45.1 -43.47 15.98 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.436 2.757 . . . . 0.0 112.448 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' B' ' 29' ' ' GLU . 15.1 m120 -129.7 -67.4 0.76 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.128 -177.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.736 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 15.4 m 67.93 120.82 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.711 -178.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.593 ' O ' ' HG3' ' B' ' 60' ' ' LYS . 21.2 pttm -118.91 81.22 19.02 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-O 121.649 0.738 . . . . 0.0 109.44 176.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -52.44 124.13 14.38 Favored 'Trans proline' 0 CA--C 1.513 -0.566 0 C-N-CA 122.924 2.416 . . . . 0.0 112.558 -177.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' ASP . . . . . 0.489 ' OD2' ' HD2' ' B' ' 63' ' ' ARG . 12.0 t70 -92.33 -73.3 0.56 Allowed 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 113.856 -1.52 . . . . 0.0 109.891 -177.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.489 ' HD2' ' OD2' ' B' ' 62' ' ' ASP . 0.1 OUTLIER -160.5 175.85 12.27 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 174.388 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -126.72 120.6 29.79 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.796 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 14.7 m -129.25 78.35 76.11 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 0.0 109.781 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 61.0 Cg_endo -81.45 145.37 14.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.317 2.011 . . . . 0.0 112.136 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 67' ' ' SER . . . . . 0.562 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.5 m -155.38 144.11 20.56 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.246 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.404 ' HE2' ' CD2' ' B' ' 70' ' ' PHE . 65.2 t80 -105.3 120.37 41.4 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.52 -177.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -99.74 114.95 28.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.424 175.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 3' ' ' HIS . 85.1 m-85 -63.88 -32.12 73.53 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.42 -176.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.27 -41.81 69.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.973 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.534 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.98 1.79 15.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.623 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.73 45.55 21.76 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.363 1.039 . . . . 0.0 111.32 -175.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.534 HG13 ' O ' ' B' ' 72' ' ' GLU . 72.3 mt -123.26 137.62 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.135 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -105.8 107.05 17.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.564 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 10.8 p90 -95.36 144.82 25.59 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.165 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 49.3 mm -91.8 -40.77 12.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.721 -175.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.9 m-20 -161.16 -175.96 5.17 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.48 7.31 40.17 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.586 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.46 -37.99 11.15 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.074 0.464 . . . . 0.0 110.21 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.485 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -159.26 153.01 22.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.944 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 10.1 p -128.16 141.62 51.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.642 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 45.5 mm -104.69 105.62 51.34 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.852 0.358 . . . . 0.0 110.673 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.442 ' HA ' HG12 ' B' ' 74' ' ' ILE . 73.6 Cg_endo -80.9 134.51 9.55 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.188 1.925 . . . . 0.0 112.632 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.48 143.84 27.17 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.76 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -67.27 142.2 59.63 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.133 1.889 . . . . 0.0 111.306 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -71.26 -5.01 28.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.125 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -75.31 -17.07 60.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.45 0.643 . . . . 0.0 109.709 178.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 53.5 mt -113.7 137.71 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.764 -176.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 60.6 t -90.64 113.9 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 2.3 p -124.53 134.57 66.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.155 0.502 . . . . 0.0 111.185 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.05 167.32 22.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.302 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.58 -23.68 64.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 111.556 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.89 -9.8 58.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.033 -177.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -113.89 -21.1 10.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.021 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 79.5 mt -75.33 117.97 20.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.354 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.418 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 10.8 mmmm -113.07 107.83 16.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.68 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.458 HG22 HG23 ' A' ' 10' ' ' VAL . 46.7 mt -110.38 120.77 61.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 0.0 111.518 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -133.23 119.52 19.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.614 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 16.9 t-80 -101.82 113.89 27.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.628 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.649 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.4 mt -89.93 108.43 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -69.2 -40.65 77.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.716 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -58.6 -47.44 84.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.108 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.649 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.3 tp10 -87.06 -3.19 59.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.191 -176.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 59.3 27.85 17.02 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.726 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 35.0 m -124.43 134.42 53.08 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.116 0.484 . . . . 0.0 111.231 -171.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' B' ' 100' ' ' HIS . 37.5 tp -103.6 123.13 46.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.098 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.588 ' CE1' HD12 ' B' ' 101' ' ' ILE . 14.8 m-85 -103.83 124.43 48.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.894 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.599 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.9 mm -112.23 120.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.619 175.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.494 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.3 m-85 -118.63 125.87 50.7 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 71.7 mt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.642 -0.694 . . . . 0.0 109.986 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.76 155.33 70.38 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.629 2.219 . . . . 0.0 111.218 177.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -124.51 9.71 8.44 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 23.7 mmt -91.35 -177.76 4.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.041 0.448 . . . . 0.0 111.039 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 p -134.26 141.25 46.92 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.684 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.479 HG21 ' HB2' ' B' ' 93' ' ' ALA . 27.6 m -134.09 164.32 34.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.349 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.03 153.75 24.18 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.446 ' HB ' HD12 ' B' ' 98' ' ' ILE . 5.2 mm -118.74 128.24 26.08 Favored Pre-proline 0 C--N 1.307 -1.25 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.413 -174.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.98 135.07 24.63 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.452 2.102 . . . . 0.0 111.939 177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.493 HG23 HG22 ' B' ' 98' ' ' ILE . 2.6 p -113.64 130.81 67.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.173 0.511 . . . . 0.0 110.566 178.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.76 HG12 ' HA ' ' B' ' 99' ' ' PHE . 4.0 p -86.22 149.03 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.512 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.581 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 34.6 mt-10 -115.81 94.46 4.69 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.595 0.712 . . . . 0.0 110.225 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.429 HG13 HG22 ' A' ' 11' ' ' VAL . 10.2 m -114.16 179.72 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.492 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -95.62 -24.9 16.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.365 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -168.36 163.0 12.78 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.415 176.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.4 mt -83.48 154.02 65.57 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-O 121.066 0.46 . . . . 0.0 111.674 -175.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 165.93 31.13 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.894 2.396 . . . . 0.0 111.428 176.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.413 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -61.54 136.36 57.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.341 -179.142 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -4.75 29.99 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.817 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -111.13 139.01 46.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.376 0.608 . . . . 0.0 111.856 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -93.74 94.69 8.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.81 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.621 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 31.6 ttp85 -97.49 145.72 25.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.27 0.557 . . . . 0.0 111.54 -175.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.402 ' H ' ' HE2' ' B' ' 108' ' ' TYR . 50.5 m . . . . . 0 C--O 1.248 1.0 0 CA-C-N 115.216 -0.902 . . . . 0.0 108.996 176.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo . . . . . 0 N--CA 1.481 0.749 0 N-CA-C 110.747 -0.52 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -166.13 -46.05 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.172 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -100.81 117.08 34.17 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.007 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -82.45 -177.67 6.77 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.056 0.455 . . . . 0.0 111.278 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -59.38 166.55 2.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.788 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -107.33 -8.93 16.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.604 177.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.35 -20.81 46.89 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.688 177.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -56.47 122.62 51.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.083 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -66.56 129.61 21.63 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.575 2.183 . . . . 0.0 111.973 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.519 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 22.3 tt0 -106.47 96.87 6.77 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.393 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.504 ' HB2' HD21 ' B' ' 81' ' ' LEU . 85.8 m-85 -86.04 157.68 20.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.497 -177.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.425 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 36.8 tt0 -131.51 119.18 21.19 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 171.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.79 136.32 27.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.466 -175.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.447 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -130.88 146.41 52.3 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 176.652 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.613 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.6 OUTLIER -124.75 136.64 54.04 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -177.332 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.479 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.1 tmtp? -136.58 129.49 30.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.742 0.306 . . . . 0.0 110.185 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.474 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 6.7 mpt_? -97.11 134.3 40.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.023 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.479 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.0 m-85 -114.2 164.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.454 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -144.35 119.23 9.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.784 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.72 43.79 93.56 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.804 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -124.56 171.35 10.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -19.24 65.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.293 0.568 . . . . 0.0 110.688 178.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.504 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.04 136.36 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.228 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.511 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.0 mppt? -87.68 -25.1 23.66 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.09 0.472 . . . . 0.0 110.041 -173.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.613 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.17 138.9 35.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.642 -178.215 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -122.97 119.9 31.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.709 175.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.584 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.0 mp -113.64 128.06 70.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.4 mm? -110.68 117.46 33.53 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.082 -178.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -124.06 103.99 13.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.509 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.6 pt-20 -108.36 149.28 28.91 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.484 -178.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.62 113.0 24.53 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.768 -177.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -133.51 93.95 3.23 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.508 0.67 . . . . 0.0 110.74 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.519 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.09 161.59 61.61 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.807 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.489 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 11.9 Cg_endo -55.5 -45.16 41.78 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.223 1.948 . . . . 0.0 111.553 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -136.69 64.1 1.55 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.035 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 1.5 m -64.23 110.99 2.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.477 -176.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -138.92 78.04 30.69 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.625 175.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.94 149.59 90.24 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.601 2.201 . . . . 0.0 112.001 -178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -73.89 -38.21 64.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.68 -178.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -172.03 169.07 5.73 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.415 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -122.18 108.07 12.88 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 168.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.2 m -137.41 80.18 33.99 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-O 120.917 0.389 . . . . 0.0 110.096 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.95 150.02 23.17 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.587 2.192 . . . . 0.0 111.948 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 9.6 m -154.65 150.05 27.25 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.426 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.498 ' HB2' HD23 ' B' ' 75' ' ' LEU . 61.9 t80 -115.08 124.43 51.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.365 0.603 . . . . 0.0 111.19 -176.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -105.03 113.43 27.02 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.389 174.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.403 ' CD2' ' HE2' ' B' ' 68' ' ' TYR . 88.1 m-85 -63.9 -32.82 74.48 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.907 -176.038 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.73 70.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.727 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.511 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -109.9 2.98 20.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.208 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.83 44.7 18.31 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.477 1.11 . . . . 0.0 111.36 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.511 HG13 ' O ' ' B' ' 72' ' ' GLU . 61.6 mt -121.49 134.16 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.484 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.498 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -101.95 107.09 18.13 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 176.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.38 140.61 29.41 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 41.2 mm -91.63 -59.62 2.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.051 0.453 . . . . 0.0 110.655 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -149.68 -179.48 7.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.326 -178.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.12 6.44 7.1 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.244 177.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -94.43 -43.41 8.38 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.506 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.6 pp -157.82 153.72 26.89 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.708 -177.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 41.3 t -130.12 149.06 51.99 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.683 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.1 mm -112.6 105.77 55.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.897 0.38 . . . . 0.0 111.104 -174.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -79.04 136.86 13.3 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.352 2.034 . . . . 0.0 112.416 177.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.46 156.08 35.6 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.284 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.456 ' HG2' HD12 ' B' ' 89' ' ' ILE . 31.9 Cg_endo -64.92 141.06 69.29 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.31 2.007 . . . . 0.0 111.492 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.525 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 8.4 mpt_? -80.1 1.81 26.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.778 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.5 -20.28 28.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.286 0.565 . . . . 0.0 109.974 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.456 HD12 ' HG2' ' B' ' 86' ' ' PRO . 62.2 mt -103.99 134.61 44.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.601 -174.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.6 t -84.17 110.13 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.696 177.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 45.2 t -111.78 132.56 60.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.499 -175.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.463 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.78 161.15 38.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.78 178.757 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.479 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.29 -18.0 63.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.699 -176.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.65 -12.36 54.08 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.463 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 21.9 t70 -110.99 -24.04 10.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.097 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.407 HG22 HG13 ' B' ' 98' ' ' ILE . 84.6 mt -71.42 113.43 7.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.197 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.447 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.5 mmmt -109.54 105.7 15.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.93 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.493 HG22 HG23 ' A' ' 10' ' ' VAL . 57.0 mt -109.73 121.87 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.073 0.463 . . . . 0.0 111.69 -177.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.76 ' HA ' HG12 ' A' ' 11' ' ' VAL . 88.3 m-85 -129.07 118.41 22.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.627 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.581 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 19.9 t-80 -99.39 106.66 18.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.097 0.475 . . . . 0.0 109.859 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.61 HD12 ' CE1' ' B' ' 108' ' ' TYR . 70.4 mt -87.24 115.24 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.698 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 102' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 102' ' ' ARG . 33.2 mtp85 -77.25 -19.31 56.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.399 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -57.63 -48.56 79.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.767 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.51 ' H ' HG22 ' B' ' 101' ' ' ILE . 63.1 mm-40 -106.85 0.28 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.707 -179.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 54.07 40.54 31.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.83 -172.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.509 HG23 ' HB3' ' B' ' 53' ' ' GLU . 50.7 m -119.65 137.35 53.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.815 -174.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.75 119.6 39.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.424 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.621 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 24.5 m-85 -101.81 123.01 45.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.732 178.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.56 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.9 mm -113.19 119.44 60.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.947 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.447 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 88.8 m-85 -118.84 128.69 54.69 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.504 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.2 mt . . . . . 0 C--O 1.243 0.754 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.352 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.793 0 N-CA-C 111.934 -0.466 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.73 -32.63 95.96 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 123.061 2.507 . . . . 0.0 112.773 -177.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -138.05 33.97 2.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.642 0.734 . . . . 0.0 109.511 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 13.8 tpt -58.88 125.43 23.52 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.738 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.0 p -153.46 144.51 22.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.592 -175.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -128.53 144.19 38.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.669 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.76 137.33 33.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.904 0.383 . . . . 0.0 110.004 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.417 ' HB ' HD12 ' B' ' 98' ' ' ILE . 10.4 mm -108.05 120.31 47.29 Favored Pre-proline 0 C--N 1.316 -0.849 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.13 127.7 16.37 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.23 1.953 . . . . 0.0 112.178 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.488 HG23 HG22 ' B' ' 98' ' ' ILE . 2.2 p -102.46 127.12 56.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.535 HG12 HG13 ' A' ' 13' ' ' VAL . 47.8 t -95.02 125.73 47.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.056 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.462 ' OE1' ' HD2' ' B' ' 102' ' ' ARG . 44.3 mt-10 -90.55 107.04 18.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.215 0.531 . . . . 0.0 110.253 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.672 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 11.0 m -126.63 177.4 5.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.357 -179.221 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -98.64 -16.97 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.008 0.432 . . . . 0.0 110.03 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -170.52 159.1 6.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.574 178.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.456 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.5 mm? -76.83 150.72 81.77 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.08 172.83 13.14 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.272 1.981 . . . . 0.0 111.634 174.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.52 139.51 58.23 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.139 0.495 . . . . 0.0 111.004 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.83 -15.0 37.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.132 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -95.35 166.71 11.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.89 0.376 . . . . 0.0 111.427 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -123.41 96.25 4.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.46 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.456 ' HB2' HD23 ' A' ' 16' ' ' LEU . 22.5 ttp85 -100.1 145.3 28.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.125 178.021 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.6 m . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.814 -179.699 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo . . . . . 0 N--CA 1.477 0.505 0 N-CA-C 110.454 -0.633 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 -86.37 79.67 8.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.217 0.532 . . . . 0.0 110.282 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -96.05 160.58 14.38 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.946 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -116.85 142.56 46.77 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 121.014 0.435 . . . . 0.0 110.512 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' GLN . . . . . 0.503 ' H ' ' CG2' ' B' ' 31' ' ' VAL . 76.3 mm-40 -133.61 -166.96 1.86 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.994 178.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -83.75 -29.98 27.02 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.007 177.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -67.34 -20.68 65.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.482 -179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.503 ' CG2' ' H ' ' B' ' 28' ' ' GLN . 59.8 t -69.8 118.58 64.49 Favored Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-N 115.23 -0.895 . . . . 0.0 111.08 -176.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.615 ' HB3' HD22 ' B' ' 54' ' ' ASN . 32.7 Cg_endo -67.84 130.82 22.63 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.878 2.385 . . . . 0.0 113.143 -179.235 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.631 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 39.0 tt0 -91.28 98.18 11.56 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.65 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -83.82 157.2 22.13 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.014 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -133.12 119.59 20.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.009 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.6 t -96.09 133.52 37.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.888 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.467 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.02 120.58 27.79 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.04 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.582 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.2 ttt -105.09 145.93 29.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.497 0.189 . . . . 0.0 110.614 -174.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.445 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.48 132.89 18.59 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -176.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.445 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.59 136.41 36.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.101 0.477 . . . . 0.0 110.86 179.702 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -117.57 167.65 11.12 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.363 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -156.59 109.43 2.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.938 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.4 11.85 46.85 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.305 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -111.69 171.59 7.4 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.15 -24.77 63.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.354 0.597 . . . . 0.0 110.706 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.652 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.4 p90 -124.42 142.75 51.06 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.859 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -102.04 -18.55 15.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.98 -175.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.624 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -140.23 132.93 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.823 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -119.67 120.32 36.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 177.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.624 HD11 HD12 ' B' ' 48' ' ' LEU . 2.0 mp -118.05 129.21 74.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.497 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.03 114.58 26.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.188 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.43 103.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -110.33 152.92 25.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.262 0.554 . . . . 0.0 111.118 -176.063 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' ASN . . . . . 0.615 HD22 ' HB3' ' B' ' 32' ' ' PRO . 32.7 t-20 -94.6 113.35 25.15 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.053 -178.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -137.94 91.48 2.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.171 0.51 . . . . 0.0 110.467 176.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.631 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -138.67 162.2 54.3 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.016 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.433 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 36.3 Cg_endo -67.85 -43.04 5.62 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.136 1.891 . . . . 0.0 112.677 176.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -128.31 36.35 4.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.052 0.453 . . . . 0.0 111.552 -171.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.528 ' HB3' ' HA ' ' B' ' 32' ' ' PRO . 1.1 p -72.1 124.93 26.03 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.097 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -132.38 75.28 74.4 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.844 175.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.34 143.04 62.36 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.852 2.368 . . . . 0.0 112.599 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -85.66 -72.12 0.5 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.858 178.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -156.81 -172.45 4.05 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.569 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -135.86 131.18 34.98 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.319 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.7 m -137.09 79.23 38.39 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-O 121.164 0.507 . . . . 0.0 109.829 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -76.27 153.0 35.55 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.865 2.377 . . . . 0.0 112.668 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.9 m -153.91 147.33 24.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.138 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -103.92 120.73 41.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.304 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.446 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.8 p30 -100.2 112.38 24.7 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.386 176.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -63.1 -33.21 74.95 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.595 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.13 77.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.875 -175.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.487 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -112.45 3.4 16.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.257 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 8.9 p30 47.05 45.77 15.85 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.38 1.072 . . . . 0.0 111.616 -176.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.494 HG12 ' HA ' ' B' ' 84' ' ' PRO . 63.7 mt -121.4 139.29 48.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.065 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -102.22 102.54 12.96 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.0 140.88 29.42 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -177.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -94.75 -54.43 7.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.469 -177.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -149.64 178.79 8.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.49 6.6 15.87 Favored Glycine 0 CA--C 1.517 0.184 0 C-N-CA 120.659 -0.781 . . . . 0.0 111.939 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -96.21 -37.3 10.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.49 . . . . 0.0 110.066 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.427 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -158.01 151.92 24.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 112.094 178.618 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.0 p -128.78 148.72 50.88 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.67 177.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.418 HG21 HG12 ' B' ' 50' ' ' ILE . 49.5 mm -105.86 104.25 48.09 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.896 0.379 . . . . 0.0 110.391 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.494 ' HA ' HG12 ' B' ' 74' ' ' ILE . 61.4 Cg_endo -75.48 131.76 14.1 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.245 1.963 . . . . 0.0 112.211 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 54.0 mt -101.32 146.5 32.3 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.237 -175.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.437 ' HG2' HD12 ' B' ' 89' ' ' ILE . 33.0 Cg_endo -66.65 142.85 65.82 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.276 1.984 . . . . 0.0 111.4 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.434 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 9.2 mpt_? -78.24 1.01 22.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.533 -175.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -93.28 -1.4 56.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.579 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.437 HD12 ' HG2' ' B' ' 86' ' ' PRO . 60.0 mt -116.73 137.92 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 67.1 t -87.03 113.02 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 1.6 p -125.27 132.49 71.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.311 0.577 . . . . 0.0 111.393 -174.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.37 163.64 32.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.028 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.23 63.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.67 -13.4 51.59 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -111.28 -21.19 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.111 -175.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.41 HG22 HG21 ' A' ' 8' ' ' ILE . 82.0 mt -75.73 118.56 22.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.169 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.47 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.1 mmmt -111.98 107.72 16.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.114 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.488 HG22 HG23 ' A' ' 10' ' ' VAL . 53.4 mt -111.42 121.43 63.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.983 0.421 . . . . 0.0 111.364 -178.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -132.66 122.53 24.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.205 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.433 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 45.3 t60 -102.86 110.7 22.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.998 0.428 . . . . 0.0 110.752 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.761 HG22 ' H ' ' B' ' 104' ' ' GLU . 56.1 mt -91.16 114.18 28.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.195 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 102' ' ' ARG . . . . . 0.462 ' HD2' ' OE1' ' A' ' 12' ' ' GLU . 39.5 mtp85 -81.06 -26.09 36.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.126 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.4 tttp -58.55 -42.31 87.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.337 177.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.761 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.6 tp10 -105.29 1.7 28.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.306 0.574 . . . . 0.0 110.002 -177.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 55.47 31.47 17.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.903 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 37.2 m -123.49 139.95 53.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 121.015 0.436 . . . . 0.0 110.939 -173.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.53 121.32 44.05 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.799 178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.637 ' CE1' HD12 ' B' ' 101' ' ' ILE . 8.4 m-85 -100.42 126.36 46.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.245 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.57 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 39.0 mm -115.94 117.73 56.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.732 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.47 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 87.3 m-85 -119.01 123.04 43.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.652 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 68.1 mt . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.745 -0.645 . . . . 0.0 109.807 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.722 0 N-CA-C 111.846 -0.502 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.78 63.14 4.82 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.902 2.401 . . . . 0.0 112.39 179.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.516 ' O ' ' HB2' ' A' ' 4' ' ' MET . 37.8 t-80 -150.62 154.06 36.81 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.628 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' A' ' 3' ' ' HIS . 46.9 mmm 76.8 161.67 0.23 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.886 0.741 . . . . 0.0 112.094 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 39.2 p -129.93 137.63 50.46 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.73 176.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.466 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.0 m -120.66 140.1 45.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.013 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.435 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -86.54 139.45 30.84 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.768 -179.223 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.448 ' HB ' HD12 ' B' ' 98' ' ' ILE . 5.1 mm -112.13 119.6 43.67 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -70.54 128.73 15.71 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.236 1.957 . . . . 0.0 112.105 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG13 HG22 ' B' ' 98' ' ' ILE . 48.0 t -83.58 135.45 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.135 178.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.581 HG12 HG13 ' A' ' 13' ' ' VAL . 38.6 t -99.18 111.07 27.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.506 ' OE1' ' HD3' ' B' ' 102' ' ' ARG . 45.1 mt-10 -85.9 102.21 13.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 0.0 110.605 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.581 HG13 HG12 ' A' ' 11' ' ' VAL . 5.8 m -123.16 -176.46 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.072 -178.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -94.43 -29.96 14.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -162.61 162.93 27.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.534 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.458 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -81.72 143.45 50.61 Favored Pre-proline 0 N--CA 1.448 -0.539 0 CA-C-O 120.776 0.322 . . . . 0.0 110.817 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -51.62 171.0 0.16 Allowed 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 123.931 3.087 . . . . 0.0 113.469 174.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -65.59 141.13 58.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.494 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.48 -4.6 60.09 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.493 -0.861 . . . . 0.0 111.22 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.71 164.76 11.72 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.48 94.36 4.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.042 0.449 . . . . 0.0 111.563 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.458 ' HB2' HD23 ' A' ' 16' ' ' LEU . 13.4 ttp180 -101.33 147.53 26.21 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.8 t . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.238 -175.831 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo . . . . . 0 N--CA 1.481 0.755 0 N-CA-C 110.254 -0.71 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -160.03 146.61 15.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 60.9 71.68 0.55 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.543 0.687 . . . . 0.0 110.287 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -118.94 149.91 40.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.561 -175.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -83.54 157.63 22.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.683 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -98.2 -6.37 31.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.684 -178.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ASP . . . . . 0.458 ' HA ' ' HB2' ' B' ' 58' ' ' ASN . 4.6 m-20 -92.28 3.11 56.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.242 179.092 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -66.43 116.49 34.57 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.073 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.97 130.29 28.66 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.56 2.173 . . . . 0.0 112.783 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.6 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.1 tt0 -111.15 103.0 11.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.191 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.8 m-85 -86.39 156.51 20.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.602 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.536 ' OE2' ' HE2' ' B' ' 37' ' ' LYS . 35.0 tt0 -129.24 118.64 22.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.506 -0.77 . . . . 0.0 108.983 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -94.29 133.88 33.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.412 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.536 ' HE2' ' OE2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -128.84 145.41 51.21 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.382 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -125.68 138.38 53.89 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.442 -178.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.598 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 6.6 tmtm? -142.13 135.12 28.74 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -173.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.443 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 7.7 mpt_? -99.07 133.33 43.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.813 0.339 . . . . 0.0 111.122 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.598 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 45.8 m-85 -118.44 150.79 38.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.619 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -134.39 120.94 20.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.642 177.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.36 26.49 51.54 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.578 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.22 171.81 8.03 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -20.53 65.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.335 0.588 . . . . 0.0 110.391 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.6 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -126.38 142.01 51.69 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.983 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.505 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.6 mppt? -101.81 -21.53 14.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.599 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.76 130.52 25.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.899 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -116.11 129.73 56.47 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.599 HD11 HD12 ' B' ' 48' ' ' LEU . 2.7 mp -122.06 130.64 74.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.542 HD11 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -116.47 123.59 47.86 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.277 -176.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.7 mp -125.61 103.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.545 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.1 pt-20 -108.38 153.6 23.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.949 0.404 . . . . 0.0 110.191 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.18 113.6 25.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.662 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -135.65 93.19 2.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.6 0.714 . . . . 0.0 110.318 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.6 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -137.24 167.52 20.47 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.48 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.59 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 11.0 Cg_endo -54.54 -42.32 69.22 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.358 2.039 . . . . 0.0 111.419 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 58' ' ' ASN . . . . . 0.458 ' HB2' ' HA ' ' B' ' 30' ' ' ASP . 28.1 m-80 -137.38 77.8 1.66 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.618 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 4.6 m -75.42 111.87 11.15 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.796 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -132.44 71.26 79.34 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.197 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -72.04 143.64 40.9 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.133 1.889 . . . . 0.0 110.908 174.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -113.0 -67.64 0.99 Allowed 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.13 -175.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.07 163.76 20.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.191 0.52 . . . . 0.0 110.927 177.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -132.17 127.77 36.59 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.302 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.2 m -130.58 78.81 73.35 Favored Pre-proline 0 C--N 1.318 -0.769 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.208 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.458 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 94.8 Cg_endo -84.54 156.02 12.23 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.557 2.171 . . . . 0.0 112.492 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.8 p -162.11 139.67 8.56 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.112 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.446 ' HB2' HD23 ' B' ' 75' ' ' LEU . 60.7 t80 -104.34 128.05 52.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.436 -178.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.551 HD21 ' HB2' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -105.37 132.59 51.37 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -79.61 -25.74 41.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.499 -178.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.66 -51.11 66.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.143 0.496 . . . . 0.0 110.841 -175.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.551 ' HB2' HD21 ' B' ' 69' ' ' ASN . 2.4 mt-10 -104.68 -3.39 23.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.15 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 73' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 2.3 p-10 57.74 43.67 21.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.088 0.947 . . . . 0.0 110.909 173.671 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' B' ' 72' ' ' GLU . 62.4 mt -119.84 134.28 63.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.14 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.446 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.6 tm? -105.48 103.3 12.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.971 178.54 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -91.43 146.56 23.7 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.54 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 40.3 mm -99.01 -51.86 9.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.481 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.445 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.9 m-20 -155.67 179.48 9.15 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.31 33.92 1.12 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.381 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' LYS . . . . . 0.445 ' H ' ' C ' ' B' ' 78' ' ' ASN . 31.5 mmtp -124.12 -42.04 2.17 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.428 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.7 OUTLIER -155.23 153.39 30.58 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.802 -178.191 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 54.9 p -127.69 141.76 51.52 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.231 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -104.67 104.65 46.78 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-O 120.815 0.34 . . . . 0.0 110.63 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.05 132.9 8.65 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 122.213 1.942 . . . . 0.0 111.942 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -95.58 147.36 32.88 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.892 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.48 ' HG2' HD12 ' B' ' 89' ' ' ILE . 34.8 Cg_endo -66.11 139.02 54.15 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.188 1.926 . . . . 0.0 111.396 176.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.02 -5.13 39.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.553 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.89 -20.09 58.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.842 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.48 HD12 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -111.67 137.26 45.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.446 -176.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 6.4 p -88.57 122.71 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 47.5 t -122.55 136.09 60.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.58 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.54 164.15 30.99 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.763 176.889 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.466 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.04 -22.37 66.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.144 0.497 . . . . 0.0 111.197 -176.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -11.88 57.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.867 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.58 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 15.5 t70 -105.18 -25.06 12.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.511 -177.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.414 HG22 HG13 ' B' ' 98' ' ' ILE . 72.0 mt -75.66 119.13 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.433 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.408 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 11.6 mmmm -113.23 100.34 8.5 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.753 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.448 HD12 ' HB ' ' A' ' 8' ' ' ILE . 45.3 mt -104.44 118.43 51.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 121.026 0.441 . . . . 0.0 111.211 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -129.8 119.02 22.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.574 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.429 ' HB2' HD13 ' B' ' 107' ' ' LEU . 85.2 t60 -101.57 121.49 42.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.81 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.543 HG22 ' H ' ' B' ' 104' ' ' GLU . 76.9 mt -101.86 116.2 45.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.463 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 102' ' ' ARG . . . . . 0.506 ' HD3' ' OE1' ' A' ' 12' ' ' GLU . 21.4 mtm180 -81.2 -39.77 24.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.647 -174.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.41 -32.54 71.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.337 0.589 . . . . 0.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.543 ' H ' HG22 ' B' ' 101' ' ' ILE . 32.6 tt0 -101.36 -5.47 25.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.129 -178.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 34.5 mtm180 51.03 37.77 18.76 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.766 -1.107 . . . . 0.0 111.779 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.411 HG23 ' HB3' ' B' ' 53' ' ' GLU . 45.7 m -128.41 139.68 52.23 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.797 -175.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 107' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' B' ' 100' ' ' HIS . 52.5 tp -111.19 117.19 32.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.542 ' CE2' HD11 ' B' ' 51' ' ' LEU . 44.0 m-85 -98.62 124.5 43.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.322 -178.019 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.473 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 45.0 mm -113.11 117.01 54.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.108 178.146 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 72.8 m-85 -118.71 127.66 53.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 177.159 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.6 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 64.1 mt . . . . . 0 C--O 1.248 1.013 0 CA-C-O 119.035 -0.507 . . . . 0.0 109.778 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.866 -0.494 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -63.81 -66.0 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.581 2.187 . . . . 0.0 111.404 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.571 ' HA ' ' HB2' ' B' ' 71' ' ' ALA . 20.9 m-70 -128.95 -79.96 0.57 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 175.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 39.3 tpp 65.27 124.15 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 122.066 0.936 . . . . 0.0 112.075 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 21.2 p -139.81 129.63 24.67 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.03 179.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.45 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.4 m -116.76 136.61 53.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.448 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.8 138.11 31.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -176.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.489 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.13 121.11 42.62 Favored Pre-proline 0 C--N 1.319 -0.751 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.351 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.91 135.54 23.54 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 122.58 2.187 . . . . 0.0 112.482 178.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.495 HG13 HG22 ' B' ' 98' ' ' ILE . 26.0 t -98.8 134.75 36.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.982 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.842 HG12 ' HA ' ' B' ' 99' ' ' PHE . 3.6 p -89.6 148.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.526 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -115.27 94.22 4.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.733 0.778 . . . . 0.0 110.237 170.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.429 HG13 HG22 ' A' ' 11' ' ' VAL . 5.1 m -115.43 -171.75 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.358 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.402 ' O ' HG12 ' B' ' 101' ' ' ILE . 6.4 m-20 -99.19 -30.75 12.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -153.82 178.05 10.33 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.406 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.45 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -84.6 149.36 54.18 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.393 173.974 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.442 ' HG2' ' CE1' ' A' ' 20' ' ' TYR . 39.7 Cg_endo -68.94 165.21 30.76 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.046 1.831 . . . . 0.0 111.472 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.05 135.41 56.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.097 0.475 . . . . 0.0 110.869 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.46 -5.27 29.77 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.815 -174.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' A' ' 17' ' ' PRO . 65.0 m-85 -106.35 176.8 5.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 0.0 111.318 177.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -131.54 97.35 4.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.538 -178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.591 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 64.3 ttp85 -93.82 145.98 24.21 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.501 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.6 t . . . . . 0 C--O 1.245 0.866 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 178.997 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.48 0.721 0 N-CA-C 111.44 -0.254 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -91.46 -62.39 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 58.38 -158.48 0.29 Allowed 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.791 0.682 . . . . 0.0 111.293 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.423 ' CD ' ' H ' ' B' ' 27' ' ' GLN . 0.3 OUTLIER -83.29 164.93 19.76 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 175.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.03 153.44 43.78 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.445 0.641 . . . . 0.0 111.021 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' B' ' 58' ' ' ASN . 11.5 pt-20 -85.21 -20.43 30.17 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.361 -177.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ASP . . . . . 0.587 ' HA ' ' O ' ' B' ' 58' ' ' ASN . 5.1 p-10 -87.05 -2.48 58.66 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.163 -178.024 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.76 119.01 50.7 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.437 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.95 129.12 16.86 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.413 2.075 . . . . 0.0 111.645 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.607 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 33.7 tt0 -102.55 98.09 8.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.502 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.9 m-85 -83.11 148.17 27.66 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.753 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -120.37 114.66 22.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.283 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 82.8 t -94.62 125.22 47.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.503 -178.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.487 ' HB2' ' HB2' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -123.23 142.49 50.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.204 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.577 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.5 OUTLIER -127.4 137.83 52.84 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 121.169 -0.212 . . . . 0.0 110.552 -174.504 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.504 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.5 tmtt? -145.58 132.9 20.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.653 0.263 . . . . 0.0 110.362 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.504 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -93.09 139.56 30.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.358 -177.835 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.432 ' CE2' ' HE1' ' B' ' 46' ' ' TYR . 23.9 m-85 -121.49 167.67 12.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.31 176.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -156.4 112.0 2.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.075 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 97.66 16.81 32.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.056 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.09 172.09 7.27 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.7 -18.91 63.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.114 0.483 . . . . 0.0 110.87 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.586 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 2.4 p90 -130.69 147.85 52.41 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.508 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.43 -20.07 14.19 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.203 0.525 . . . . 0.0 109.806 -177.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.577 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -136.23 133.52 37.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.498 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.7 ttp180 -115.83 115.6 26.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.405 176.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.597 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -114.64 131.86 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.572 HD11 ' CD2' ' B' ' 108' ' ' TYR . 4.2 mm? -115.23 122.91 47.44 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.989 -178.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.63 103.46 11.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 176.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.502 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.8 pt-20 -113.05 153.42 28.16 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.072 0.463 . . . . 0.0 110.477 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 54' ' ' ASN . . . . . 0.435 HD22 ' C ' ' B' ' 54' ' ' ASN . 0.2 OUTLIER -96.37 110.05 22.46 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.885 -177.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -135.67 93.17 2.91 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.509 0.671 . . . . 0.0 110.775 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.607 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.29 163.81 47.38 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.26 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.544 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 18.0 Cg_endo -57.53 -43.1 54.11 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.29 1.993 . . . . 0.0 111.973 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 58' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' B' ' 30' ' ' ASP . 15.0 m120 -136.72 68.94 1.42 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.974 -178.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 7.5 m -71.08 121.6 18.55 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.208 -175.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -133.04 73.09 75.78 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.026 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.69 145.62 95.07 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.78 2.32 . . . . 0.0 112.043 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -92.73 -59.36 2.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.046 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -163.43 178.87 7.72 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.546 -176.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -134.44 117.34 16.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.642 174.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 38.7 m -133.55 78.8 61.41 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-O 121.009 0.433 . . . . 0.0 110.104 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.592 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 93.2 Cg_endo -82.09 150.89 15.93 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.569 2.179 . . . . 0.0 112.193 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -158.33 144.71 17.31 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.125 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.463 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 45.2 t80 -102.71 118.3 36.54 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.615 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.423 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.9 OUTLIER -101.18 115.84 31.42 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.753 176.248 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -63.8 -26.26 68.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.619 -178.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.571 ' HB2' ' HA ' ' A' ' 3' ' ' HIS . . . -52.0 -49.13 63.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.784 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.585 ' O ' HG13 ' B' ' 74' ' ' ILE . 11.2 mt-10 -112.08 2.44 16.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.16 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 8.2 p30 47.69 46.02 18.12 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.54 1.15 . . . . 0.0 110.811 -174.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.585 HG13 ' O ' ' B' ' 72' ' ' GLU . 84.7 mt -120.85 137.09 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.097 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.434 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.3 tm? -100.11 100.71 11.61 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 177.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.592 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -87.82 137.61 32.19 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.597 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.2 mm -89.79 -49.11 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.403 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -151.59 -177.57 6.18 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.55 0.96 54.03 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.238 -0.982 . . . . 0.0 111.918 176.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -94.25 -34.77 12.74 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.81 0.338 . . . . 0.0 110.411 -176.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.4 OUTLIER -157.0 152.39 26.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.802 178.041 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' B' ' 84' ' ' PRO . 35.8 p -128.45 150.0 50.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.105 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -107.77 98.82 26.65 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-O 120.821 0.344 . . . . 0.0 110.553 -179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.541 ' HA ' HG12 ' B' ' 74' ' ' ILE . 14.5 Cg_exo -70.53 135.95 29.81 Favored 'Trans proline' 0 CA--C 1.515 -0.429 0 C-N-CA 122.558 2.172 . . . . 0.0 112.127 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.03 147.84 35.17 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.257 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.457 ' HG2' HD12 ' B' ' 89' ' ' ILE . 36.8 Cg_endo -66.96 139.27 50.8 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.251 1.967 . . . . 0.0 111.64 178.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -7.72 52.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.683 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -80.41 -13.74 58.89 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.636 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.457 HD12 ' HG2' ' B' ' 86' ' ' PRO . 61.1 mt -113.9 133.44 59.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.058 -174.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 8.8 p -83.94 125.57 40.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.464 176.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 91' ' ' VAL . . . . . 0.463 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.3 p -137.23 137.45 46.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 111.447 -174.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.487 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -139.73 165.62 26.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.618 177.926 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.45 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -59.54 -25.89 64.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.291 0.567 . . . . 0.0 111.237 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.95 -12.98 59.29 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.487 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 23.0 t0 -106.01 -22.57 12.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 0.0 109.639 -177.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 75.4 mt -76.39 117.11 20.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.9 mmmt -110.96 109.45 19.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.157 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.495 HG22 HG13 ' A' ' 10' ' ' VAL . 50.8 mt -113.48 118.01 57.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 121.206 0.526 . . . . 0.0 111.401 -178.127 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.842 ' HA ' HG12 ' A' ' 11' ' ' VAL . 73.7 m-85 -128.06 117.67 22.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.475 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.526 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 20.6 t-80 -98.96 110.08 22.74 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.027 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.673 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.7 mp -91.82 109.05 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -81.08 -17.74 49.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.593 -174.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -70.07 -47.61 61.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.14 0.495 . . . . 0.0 110.076 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.673 ' H ' HG22 ' B' ' 101' ' ' ILE . 18.5 mm-40 -86.71 -1.8 58.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.256 177.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 53.02 38.5 27.46 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.576 -176.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.416 HG23 ' HB3' ' B' ' 53' ' ' GLU . 40.1 m -125.88 128.12 47.09 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.099 0.476 . . . . 0.0 110.956 -173.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 107' ' ' LEU . . . . . 0.425 HD11 ' CG2' ' B' ' 98' ' ' ILE . 45.1 tp -98.9 112.57 24.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.907 177.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.591 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 61.2 m-85 -91.99 123.13 35.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.952 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.597 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.7 mm -112.12 124.9 69.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.961 177.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.496 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 87.8 m-85 -126.9 123.73 37.91 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.586 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.457 -0.783 . . . . 0.0 110.109 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.623 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.86 129.84 13.87 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.793 2.329 . . . . 0.0 112.135 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -56.04 -32.79 64.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.32 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.403 ' HG3' ' CD1' ' B' ' 70' ' ' PHE . 43.9 tpp -148.33 131.17 16.1 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.166 0.507 . . . . 0.0 110.33 174.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p -152.49 137.69 17.43 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.795 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.504 HG21 ' HB2' ' B' ' 93' ' ' ALA . 21.6 m -130.18 148.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.886 0.374 . . . . 0.0 110.569 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.484 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -92.3 138.96 31.08 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.6 mm -107.73 122.95 39.34 Favored Pre-proline 0 C--N 1.32 -0.677 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.467 -176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.11 129.02 15.55 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.293 1.995 . . . . 0.0 112.015 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.476 HG23 HG22 ' B' ' 98' ' ' ILE . 2.4 p -104.67 135.3 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.311 0.577 . . . . 0.0 110.869 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' B' ' 99' ' ' PHE . 3.5 p -86.53 148.8 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.632 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 44.2 mt-10 -115.23 93.75 4.43 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.565 0.698 . . . . 0.0 110.047 170.284 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 12.6 m -116.06 -173.44 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.938 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.54 -22.48 16.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.569 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -169.98 172.95 6.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.395 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -76.13 150.53 83.22 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.38 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 51.1 Cg_endo -71.64 172.91 13.42 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 121.948 1.765 . . . . 0.0 111.968 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -53.52 138.53 33.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.315 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.29 -9.61 53.89 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.64 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 60.7 m-85 -99.92 143.07 30.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 0.0 111.969 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -96.2 95.58 8.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.619 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.485 ' HB2' HD23 ' A' ' 16' ' ' LEU . 18.2 ttt180 -92.1 149.06 21.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.702 -175.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.408 ' H ' ' HE2' ' B' ' 108' ' ' TYR . 48.3 m . . . . . 0 C--O 1.251 1.156 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.261 173.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.474 0.338 0 N-CA-C 110.479 -0.623 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 7.1 p-80 -76.47 -21.62 55.62 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.069 0.461 . . . . 0.0 110.513 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -96.33 128.54 43.34 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -102.0 144.87 30.07 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.21 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 66.55 157.49 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 O-C-N 124.275 0.985 . . . . 0.0 112.999 177.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -108.92 2.14 21.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.998 177.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -84.19 -13.75 51.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.392 176.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 51.8 t -77.2 117.28 64.15 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.535 -170.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.506 ' HA ' ' HB3' ' B' ' 59' ' ' SER . 41.1 Cg_endo -70.38 130.04 17.93 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.475 2.116 . . . . 0.0 112.304 177.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.431 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 36.8 tt0 -90.8 97.92 11.47 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.361 177.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.481 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -87.56 153.64 21.24 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.496 176.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -125.89 118.18 24.91 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.77 126.87 48.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.869 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.58 119.12 26.29 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.665 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.2 ttt -101.85 139.64 37.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -144.98 131.65 19.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.769 0.319 . . . . 0.0 110.621 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -87.99 143.12 27.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.511 0.672 . . . . 0.0 112.586 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -131.17 152.48 50.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.074 176.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -140.97 116.3 10.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.292 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.98 16.95 58.72 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.148 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.27 172.06 7.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.758 0.313 . . . . 0.0 110.721 -177.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.02 -3.54 16.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.124 0.488 . . . . 0.0 110.864 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.461 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -147.42 140.21 24.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.523 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 3.1 mppt? -94.28 -23.29 17.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.268 0.556 . . . . 0.0 109.646 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.665 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -135.74 134.0 38.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.16 179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -116.54 123.01 46.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.476 174.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.0 mp -119.7 127.83 75.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.514 HD11 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -113.01 118.48 34.94 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -121.81 102.88 12.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 176.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.4 pt-20 -108.79 153.95 22.76 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.353 -178.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -97.67 115.34 27.75 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ptmm? -137.55 91.41 2.59 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.386 176.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.518 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -136.63 153.92 76.26 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.562 172.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -62.5 -38.34 52.74 Favored 'Trans proline' 0 CA--C 1.519 -0.227 0 C-N-CA 122.845 2.363 . . . . 0.0 110.668 172.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -135.48 99.98 4.37 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 114.749 -1.114 . . . . 0.0 108.74 -177.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.518 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 7.5 p -150.25 129.24 12.6 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.708 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' B' ' 60' ' ' LYS . 18.6 ptpt -121.56 78.69 37.77 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.355 -177.264 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.21 137.63 52.66 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.286 1.991 . . . . 0.0 112.001 176.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -104.14 -59.96 1.65 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.707 -176.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -161.52 171.65 17.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.335 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -124.96 133.89 52.84 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.194 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 49.9 m -134.9 78.96 53.02 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 64.3 Cg_endo -78.93 150.27 23.41 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.609 2.206 . . . . 0.0 112.255 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 11.4 m -155.86 147.47 22.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.384 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.46 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.0 t80 -109.8 118.58 36.87 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.709 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -99.14 113.2 25.31 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.482 175.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' PHE . . . . . 0.403 ' CD1' ' HG3' ' A' ' 4' ' ' MET . 58.2 m-85 -62.82 -32.66 73.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.907 -175.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.92 72.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.959 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.455 ' O ' HG13 ' B' ' 74' ' ' ILE . 12.1 mm-40 -112.17 1.06 16.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.198 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 47.47 46.55 17.43 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 124.521 1.138 . . . . 0.0 111.487 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.455 HG13 ' O ' ' B' ' 72' ' ' GLU . 59.3 mt -120.5 136.99 55.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.155 -178.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.46 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -103.36 101.31 11.22 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.431 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -88.76 143.52 26.86 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -178.575 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 48.1 mm -96.11 -60.89 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.271 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.32 -171.56 3.87 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.72 2.27 41.23 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.105 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -85.63 -45.78 11.39 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.506 0.67 . . . . 0.0 109.344 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.446 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -159.32 153.45 23.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.134 -176.108 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 26.7 p -124.49 148.43 47.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.799 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.73 102.07 36.36 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.804 0.335 . . . . 0.0 110.456 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.453 ' HA ' HG12 ' B' ' 74' ' ' ILE . 57.6 Cg_endo -74.22 131.82 15.75 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.081 1.854 . . . . 0.0 111.708 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.5 mt -102.28 146.76 32.9 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.236 -175.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -69.05 139.86 43.78 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.194 1.929 . . . . 0.0 111.673 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.26 -3.11 24.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.468 -176.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -81.26 -13.28 58.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.2 mt -112.52 134.72 54.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.684 -177.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 95.3 t -87.52 109.23 19.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 91' ' ' VAL . . . . . 0.447 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -119.95 135.79 59.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.255 0.55 . . . . 0.0 111.11 -173.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -139.82 165.82 26.27 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.504 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.89 -20.3 63.59 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.491 0.494 . . . . 0.0 111.682 -176.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.7 -14.12 46.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -105.78 -23.97 12.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.723 0.773 . . . . 0.0 109.768 -177.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.09 117.08 14.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.387 177.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 25.7 mmmt -110.91 108.27 18.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.091 178.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.476 HG22 HG23 ' A' ' 10' ' ' VAL . 54.3 mt -112.74 119.74 61.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.203 -177.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.833 ' HA ' HG12 ' A' ' 11' ' ' VAL . 75.7 m-85 -128.71 117.01 20.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.87 -178.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.514 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 17.4 t-80 -98.55 113.83 26.01 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.905 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.605 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.8 mp -91.11 126.07 43.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 75.1 mtm180 -80.72 -45.43 17.11 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.354 -173.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.74 -47.5 83.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -177.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.605 ' H ' HG22 ' B' ' 101' ' ' ILE . 45.2 mm-40 -81.62 -1.05 45.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 105' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 104' ' ' GLU . 12.5 ptm180 44.12 41.79 4.44 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.166 0.916 . . . . 0.0 111.42 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -127.46 141.77 51.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.834 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.76 118.66 35.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.41 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.514 ' CE2' HD11 ' B' ' 51' ' ' LEU . 38.4 m-85 -98.62 131.48 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.36 -179.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.6 mm -119.74 123.01 70.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.068 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.416 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 89.1 m-85 -123.53 130.39 52.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 176.298 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.461 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.915 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.856 0 N-CA-C 112.059 -0.416 . . . . 0.0 112.059 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.77 -1.56 10.96 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.248 2.632 . . . . 0.0 113.146 -175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -122.21 30.36 6.61 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.067 0.46 . . . . 0.0 110.179 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 75.2 mtp -111.38 177.05 4.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.201 -179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.9 p -140.79 131.68 25.98 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.628 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.47 HG21 ' HB2' ' B' ' 93' ' ' ALA . 28.0 m -128.32 152.24 36.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.552 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -93.05 136.88 32.91 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.4 mm -106.5 124.11 36.7 Favored Pre-proline 0 C--N 1.319 -0.745 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.186 -178.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.3 136.87 32.6 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.403 2.069 . . . . 0.0 112.067 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.504 HG23 HG22 ' B' ' 98' ' ' ILE . 2.5 p -114.3 134.11 58.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.267 0.556 . . . . 0.0 110.744 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.825 HG12 ' HA ' ' B' ' 99' ' ' PHE . 4.1 p -89.09 149.12 4.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.664 -179.007 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.52 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 47.5 mt-10 -107.59 94.92 5.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 169.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 9.0 m -117.28 -176.11 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.586 -178.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -104.07 -29.68 10.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 176.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -151.93 166.46 31.42 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.01 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.403 HD22 ' H ' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -84.04 151.33 60.21 Favored Pre-proline 0 N--CA 1.444 -0.736 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.879 177.402 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -53.69 167.57 0.97 Allowed 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 123.523 2.816 . . . . 0.0 113.588 175.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -63.21 130.14 43.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.639 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.6 -9.75 38.16 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.797 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.1 164.1 13.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 111.561 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -103.57 153.83 20.16 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.373 175.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 ttp85 -145.22 138.82 26.75 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 171.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 C--O 1.252 1.194 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.693 -176.175 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo . . . . . 0 N--CA 1.478 0.594 0 N-CA-C 110.306 -0.69 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -81.67 121.51 26.46 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.211 0.529 . . . . 0.0 110.186 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -138.82 -166.47 2.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.41 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -84.56 142.37 30.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.912 0.387 . . . . 0.0 110.322 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.35 153.45 19.9 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.174 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -112.14 -16.86 12.94 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.208 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ASP . . . . . 0.427 ' HB2' ' HE2' ' B' ' 60' ' ' LYS . 11.5 p-10 -100.34 -0.45 38.31 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.587 178.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 8.3 p -70.15 124.61 91.07 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.971 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -63.62 128.77 23.11 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.487 2.125 . . . . 0.0 111.685 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.656 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 31.0 tt0 -105.89 100.41 9.97 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 121.472 0.653 . . . . 0.0 109.41 178.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.433 ' HB2' HD21 ' B' ' 81' ' ' LEU . 90.3 m-85 -85.23 146.14 27.22 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.771 179.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.425 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 29.7 tt0 -119.16 108.5 14.74 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 176.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.4 p -96.98 137.25 25.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.48 -175.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.51 146.28 50.87 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.155 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.476 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -126.13 143.08 51.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.519 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 7.8 tmtm? -147.03 137.99 23.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -176.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 8.0 mpt_? -99.08 139.48 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.02 0.438 . . . . 0.0 110.725 -178.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.519 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.8 m-85 -127.02 157.07 40.56 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.222 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.444 ' HB2' ' NZ ' ' B' ' 42' ' ' LYS . 0.0 OUTLIER -156.75 110.18 2.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.654 175.181 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 113.98 -1.34 24.27 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.14 171.83 7.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.567 -0.316 . . . . 0.0 110.328 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.86 -18.48 64.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.201 0.524 . . . . 0.0 110.779 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.593 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -126.39 143.04 51.31 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.805 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.513 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.54 -17.48 15.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.164 0.507 . . . . 0.0 109.832 -176.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.626 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -141.21 132.74 26.97 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.157 179.306 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.623 ' HG3' ' CE1' ' B' ' 110' ' ' TYR . 19.3 ttp180 -115.65 129.27 56.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.794 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.626 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -125.82 127.13 71.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 176.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.514 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 0.9 OUTLIER -115.32 119.55 36.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.195 -177.032 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.16 104.21 14.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.43 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.3 pt-20 -107.78 152.22 24.66 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' B' ' 59' ' ' SER . 1.7 t-20 -103.83 116.12 31.71 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.898 0.38 . . . . 0.0 110.661 -178.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -137.72 93.27 2.77 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.694 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.656 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.36 163.99 46.06 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.253 176.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.53 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 16.2 Cg_endo -57.24 -46.43 28.32 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.25 1.967 . . . . 0.0 111.909 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' B' ' 30' ' ' ASP . 14.7 m120 -135.94 61.63 1.64 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.305 -176.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.467 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 13.4 m -62.21 120.96 11.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.429 -177.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.427 ' HE2' ' HB2' ' B' ' 30' ' ' ASP . 45.6 mtmt -125.51 72.92 67.87 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.013 174.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -76.5 139.61 20.69 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.107 1.872 . . . . 0.0 111.246 172.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' ASP . . . . . 0.52 ' HB3' ' HE ' ' B' ' 63' ' ' ARG . 6.7 m-20 -84.5 -66.78 0.86 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.429 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.52 ' HE ' ' HB3' ' B' ' 62' ' ' ASP . 0.8 OUTLIER -160.75 166.82 28.04 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.996 -178.921 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -111.6 127.88 55.87 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.44 -178.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.3 p -135.12 79.54 50.04 Favored Pre-proline 0 C--N 1.317 -0.808 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.498 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.9 Cg_endo -79.44 145.83 18.97 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.379 2.052 . . . . 0.0 112.338 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.2 m -153.42 147.74 25.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.45 -177.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.495 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.5 t80 -113.01 127.64 56.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.081 0.467 . . . . 0.0 111.043 -176.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -105.33 116.46 31.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.172 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -65.9 -32.89 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.608 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.32 -53.3 55.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.535 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.527 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -105.74 7.96 32.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.713 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.72 42.37 19.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.128 0.971 . . . . 0.0 111.752 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.527 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.6 mt -116.04 137.89 48.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.489 -178.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.495 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -108.14 107.02 17.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -94.07 136.36 34.44 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.211 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 34.5 mm -90.98 -47.93 14.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.107 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -159.2 175.61 13.23 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 -173.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.24 9.65 12.73 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.296 174.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -99.54 -37.69 9.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.433 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -162.47 153.69 17.77 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.492 0.663 . . . . 0.0 112.003 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.9 t -129.42 147.89 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.909 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mm -111.39 106.67 57.12 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.999 0.428 . . . . 0.0 110.966 -175.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -74.94 134.36 17.82 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.155 1.903 . . . . 0.0 111.67 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 74.6 mt -102.37 154.95 37.07 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.684 -175.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.469 ' HG2' HD12 ' B' ' 89' ' ' ILE . 40.1 Cg_endo -68.95 141.88 49.88 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.229 1.953 . . . . 0.0 111.865 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.92 -3.14 46.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.486 -176.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.62 -9.36 56.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.287 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.469 HD12 ' HG2' ' B' ' 86' ' ' PRO . 61.2 mt -114.04 134.19 57.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.478 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.25 111.66 22.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 58.6 t -116.05 133.7 61.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.145 0.498 . . . . 0.0 111.038 -173.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.36 160.75 39.47 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.405 177.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.47 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.97 -20.62 64.04 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.173 0.511 . . . . 0.0 111.588 -176.069 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -12.99 56.66 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.249 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -110.07 -24.31 10.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.493 0.663 . . . . 0.0 109.812 -177.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 86.7 mt -69.69 118.35 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.168 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -112.98 107.38 15.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.9 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.504 HG22 HG23 ' A' ' 10' ' ' VAL . 56.8 mt -110.28 121.76 63.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 111.428 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.825 ' HA ' HG12 ' A' ' 11' ' ' VAL . 78.8 m-85 -129.12 118.84 23.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.199 -179.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.52 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 23.8 t-80 -104.44 108.64 20.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.136 0.493 . . . . 0.0 110.41 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.638 HG22 ' H ' ' B' ' 104' ' ' GLU . 66.2 mt -86.73 98.61 7.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.439 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 102' ' ' ARG . . . . . 0.434 ' HD2' ' OE2' ' A' ' 12' ' ' GLU . 14.2 ptm180 -74.8 -10.96 60.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.508 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.39 -43.15 74.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.386 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.638 ' H ' HG22 ' B' ' 101' ' ' ILE . 30.0 mm-40 -99.9 -6.86 26.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.454 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 61.35 36.96 17.3 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.502 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.43 HG23 ' HB3' ' B' ' 53' ' ' GLU . 19.4 m -123.26 142.26 51.11 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.373 -176.045 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.15 121.59 44.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.161 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.529 ' CE1' HD12 ' B' ' 101' ' ' ILE . 17.7 m-85 -106.17 130.19 54.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.163 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.575 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.4 mm -118.11 124.43 73.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.623 ' CE1' ' HG3' ' B' ' 49' ' ' ARG . 98.9 m-85 -128.62 125.02 37.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.908 0.385 . . . . 0.0 110.288 177.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.593 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 56.2 mt . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.648 -0.692 . . . . 0.0 109.718 -179.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.886 0 N-CA-C 112.005 -0.438 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.86 -58.98 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.857 2.371 . . . . 0.0 112.222 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -72.94 146.4 46.1 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -71.57 167.32 19.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.517 0.675 . . . . 0.0 112.249 -172.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.8 p -136.45 128.47 29.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.036 174.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.511 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.6 m -121.38 138.79 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.047 0.451 . . . . 0.0 111.659 -173.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -85.23 138.27 32.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.843 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.573 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.06 117.44 51.81 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -177.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.75 128.28 17.68 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.427 2.085 . . . . 0.0 112.38 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 43.5 t -91.78 131.38 39.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.665 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.8 HG12 ' HA ' ' B' ' 99' ' ' PHE . 2.3 p -87.08 147.57 5.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.573 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.0 mt-10 -115.29 93.98 4.53 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 119.705 -0.798 . . . . 0.0 109.682 168.349 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.418 HG13 HG22 ' A' ' 11' ' ' VAL . 6.9 m -110.92 -179.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.637 -176.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -86.25 -32.63 21.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.527 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.7 pt-20 -170.48 172.05 6.19 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.678 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.415 ' H ' HD22 ' A' ' 16' ' ' LEU . 1.0 OUTLIER -76.7 144.08 72.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-O 120.542 0.21 . . . . 0.0 110.45 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 40.0 Cg_endo -68.08 172.53 10.78 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.278 1.986 . . . . 0.0 111.955 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -57.05 133.64 55.14 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.488 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.25 -11.31 31.25 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.245 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 63.4 m-85 -97.58 159.49 14.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -114.81 95.23 5.12 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.792 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 -87.44 148.34 25.02 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.061 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 C--O 1.247 0.935 0 O-C-N 123.663 0.602 . . . . 0.0 111.387 -179.695 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo . . . . . 0 N--CA 1.475 0.439 0 N-CA-C 110.623 -0.568 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -140.42 84.98 1.98 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.876 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -86.75 -156.47 0.32 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -60.21 141.73 55.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.981 0.419 . . . . 0.0 110.023 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -99.6 157.43 16.46 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.833 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -101.94 -18.84 15.5 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.655 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -92.32 31.03 1.36 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.146 0.498 . . . . 0.0 110.269 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.4 t -90.5 111.11 45.64 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.807 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.83 129.29 17.27 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 121.837 1.691 . . . . 0.0 111.063 175.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.649 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.2 tt0 -102.69 102.57 12.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.417 0.627 . . . . 0.0 109.648 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.2 m-85 -86.89 138.58 31.43 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.487 175.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.45 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 22.8 tt0 -118.75 110.04 16.79 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.1 p -97.53 131.71 43.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.358 -174.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.45 ' HE2' ' HG2' ' B' ' 35' ' ' GLU . 0.1 OUTLIER -124.0 132.34 53.69 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.509 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.536 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -113.79 143.24 44.98 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.782 -176.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.525 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 7.0 tmtm? -149.47 135.49 18.88 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.12 -0.232 . . . . 0.0 110.473 -176.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.525 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER -92.28 128.98 38.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.009 0.433 . . . . 0.0 111.017 178.419 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.481 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 11.3 m-85 -114.56 138.98 49.97 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.805 176.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -138.55 106.61 5.72 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.164 0.506 . . . . 0.0 109.719 176.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 122.19 2.84 9.93 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.741 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -114.6 171.63 7.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.76 -21.06 65.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.341 0.591 . . . . 0.0 110.551 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.674 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.8 p90 -119.28 141.65 48.78 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.789 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.493 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.6 mppt? -105.42 -15.39 15.03 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.454 0.645 . . . . 0.0 109.81 -175.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.654 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.11 130.42 28.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.889 177.503 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 17.8 ttp180 -119.47 123.5 44.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.892 177.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.654 HD11 HD12 ' B' ' 48' ' ' LEU . 1.9 mp -120.54 127.21 75.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.5 mm? -110.1 112.27 24.15 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.046 -178.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -120.02 103.88 14.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.458 ' HB3' HG23 ' B' ' 106' ' ' THR . 15.6 pt-20 -109.58 153.3 24.36 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.633 -178.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -95.56 108.12 20.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.723 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -135.39 92.37 2.84 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.41 0.624 . . . . 0.0 110.255 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.649 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.49 156.27 76.52 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.938 176.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -66.12 -32.81 42.49 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.432 2.088 . . . . 0.0 112.676 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -142.48 62.14 1.42 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.22 0.533 . . . . 0.0 110.241 -176.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.516 ' HB2' ' HB3' ' B' ' 56' ' ' ALA . 8.5 t -79.77 151.41 30.37 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.037 -171.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -136.61 83.59 29.96 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.62 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -64.34 147.47 90.85 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 122.63 2.22 . . . . 0.0 111.757 175.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -116.03 -73.65 0.64 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.489 -177.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -161.04 170.42 20.54 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -125.0 119.43 28.68 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.939 0.4 . . . . 0.0 111.021 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 41.5 m -138.67 80.3 26.31 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.863 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.475 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 90.1 Cg_endo -82.92 162.23 15.93 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.87 2.38 . . . . 0.0 112.213 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.5 p -162.71 136.49 6.16 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -98.23 115.76 29.04 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.492 -179.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -96.49 114.71 26.39 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.706 176.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -63.66 -25.05 68.04 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.428 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.86 71.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.845 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.474 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.56 3.91 17.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.358 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' ASN . . . . . 0.574 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.5 p-10 47.54 45.33 17.51 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.472 1.107 . . . . 0.0 111.469 -174.297 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.474 HG13 ' O ' ' B' ' 72' ' ' GLU . 64.6 mt -123.17 137.11 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.01 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -107.17 103.72 13.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.2 OUTLIER -91.43 141.49 28.69 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.732 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 77' ' ' ILE . . . . . 0.475 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 33.7 mm -95.27 -48.36 12.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.628 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.466 ' C ' ' H ' ' B' ' 80' ' ' LYS . 9.1 t-20 -155.97 171.94 19.23 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.076 -171.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.15 38.65 1.15 Allowed Glycine 0 C--O 1.228 -0.228 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 176.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' LYS . . . . . 0.466 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.2 mmtt -130.45 -41.1 1.23 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -157.95 153.97 27.04 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.205 -175.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 49.1 p -125.61 145.42 50.15 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.226 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.0 mm -111.55 100.43 47.89 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.7 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -71.4 142.82 41.74 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.77 2.313 . . . . 0.0 112.036 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.21 142.54 25.08 Favored Pre-proline 0 C--N 1.318 -0.783 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.016 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.492 ' HG2' HD12 ' B' ' 89' ' ' ILE . 24.9 Cg_endo -63.45 139.24 69.72 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.242 1.962 . . . . 0.0 111.281 176.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.574 ' NE ' HD21 ' B' ' 73' ' ' ASN . 8.7 mpt_? -74.31 -3.18 28.68 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.259 -174.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -80.58 -19.35 45.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.524 0.678 . . . . 0.0 109.566 178.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.492 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.6 mt -104.1 131.48 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.61 -176.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.0 t -84.57 110.23 18.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 1.7 p -120.74 132.44 70.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 121.468 0.652 . . . . 0.0 111.41 -172.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -140.81 164.6 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.194 179.144 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.511 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.51 -21.28 64.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.692 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.94 -15.81 52.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.042 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -106.81 -21.91 12.88 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.65 -177.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.7 mt -74.79 119.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.267 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.497 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.4 mmmt -113.64 106.42 14.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.065 179.045 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.573 HD12 ' HB ' ' A' ' 8' ' ' ILE . 49.8 mt -109.99 121.75 63.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.174 0.511 . . . . 0.0 111.177 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.8 ' HA ' HG12 ' A' ' 11' ' ' VAL . 53.9 m-85 -130.94 124.32 30.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.132 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.573 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 26.9 t-80 -106.38 117.03 32.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.039 0.447 . . . . 0.0 110.578 177.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.611 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.0 mt -99.58 104.84 16.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 172.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.49 -21.58 48.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.403 -174.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -68.81 -43.68 75.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.016 0.436 . . . . 0.0 110.496 176.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.611 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.1 mm-40 -87.73 -7.17 57.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.284 0.564 . . . . 0.0 110.088 177.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 57.06 35.87 26.93 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.51 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.458 HG23 ' HB3' ' B' ' 53' ' ' GLU . 33.2 m -124.43 138.49 54.35 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.623 -174.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.76 123.05 48.85 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.603 ' CE1' HD12 ' B' ' 101' ' ' ILE . 19.4 m-85 -105.73 129.59 53.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.854 -176.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.2 mm -117.37 119.62 62.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.858 177.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.47 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.7 m-85 -122.49 122.7 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 176.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.674 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 68.0 mt . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.902 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.712 0 N-CA-C 112.006 -0.438 . . . . 0.0 112.006 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.75 -10.09 27.06 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.91 2.407 . . . . 0.0 112.848 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -135.53 29.43 3.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.829 0.347 . . . . 0.0 110.45 177.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 42.9 tpp -108.76 133.36 52.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.889 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 4.2 m -145.45 137.6 25.62 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.992 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' B' ' 93' ' ' ALA . 31.5 m -123.52 150.0 27.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.027 0.441 . . . . 0.0 110.721 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.44 ' CD ' ' H ' ' A' ' 7' ' ' GLN . 0.1 OUTLIER -91.4 139.66 30.51 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.762 179.099 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.474 ' HB ' HD12 ' B' ' 98' ' ' ILE . 6.0 mm -110.42 119.54 46.48 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.137 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.47 128.44 17.24 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.099 1.866 . . . . 0.0 112.207 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 HG22 ' B' ' 98' ' ' ILE . 2.6 p -105.21 135.48 43.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.811 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.679 HG21 ' HD1' ' B' ' 99' ' ' PHE . 0.9 OUTLIER -86.59 150.04 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.044 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.613 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 35.2 mt-10 -116.58 94.77 4.75 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.862 168.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 16.6 m -114.86 -171.3 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.508 -177.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -103.4 -23.15 13.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.797 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.425 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.6 pt-20 -170.27 161.68 8.33 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.204 176.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.6 150.03 69.18 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.504 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -72.96 174.17 12.39 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.805 2.337 . . . . 0.0 112.142 176.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -59.66 146.09 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.983 0.421 . . . . 0.0 110.503 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.6 -16.36 54.92 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 111.211 -0.755 . . . . 0.0 111.211 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.33 153.41 18.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -110.51 100.88 9.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.114 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -100.34 144.75 28.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.124 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.928 -0.558 . . . . 0.0 110.551 -176.146 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.478 0.61 0 N-CA-C 110.759 -0.516 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 70.07 -60.89 0.47 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.379 0.672 . . . . 0.0 111.42 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -99.74 134.24 42.93 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 177.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -87.55 156.93 19.29 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.586 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -127.69 156.65 42.04 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.46 0.648 . . . . 0.0 111.212 -177.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -154.37 -9.91 0.14 Allowed 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.91 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -78.35 -2.81 39.97 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.549 175.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.9 t -55.97 120.11 31.36 Favored Pre-proline 0 N--CA 1.444 -0.741 0 CA-C-N 114.296 -1.32 . . . . 0.0 110.344 177.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -66.18 128.95 20.53 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.261 1.974 . . . . 0.0 111.738 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.626 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 23.2 tt0 -104.68 101.37 11.01 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 121.533 0.682 . . . . 0.0 109.733 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 94.3 m-85 -85.07 157.05 20.82 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.767 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.45 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 37.7 tt0 -126.34 112.11 15.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.252 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.3 t -93.55 128.61 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 O-C-N 123.469 0.481 . . . . 0.0 111.183 -177.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.45 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -129.86 119.53 23.47 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.43 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.546 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -104.35 140.56 37.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.431 -175.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.463 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 2.2 tmtp? -149.26 138.08 21.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 110.696 -174.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 8.6 mpt_? -98.75 135.84 39.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.201 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.463 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 26.6 m-85 -115.14 143.51 45.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.188 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -127.56 101.92 6.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.336 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.55 32.04 6.17 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.541 -0.837 . . . . 0.0 112.519 178.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.19 172.1 10.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.84 -27.26 63.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.447 0.641 . . . . 0.0 110.531 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.661 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.3 p90 -120.59 143.87 48.41 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.748 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.503 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.7 mppt? -101.82 -22.35 14.38 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.418 -176.185 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.603 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.94 132.92 31.12 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.815 -178.423 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -119.75 129.57 54.56 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.603 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -124.7 127.96 73.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.494 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.1 mm? -111.04 121.54 45.62 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 52' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 4.5 mp -126.18 102.67 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 177.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.8 pt-20 -112.34 154.34 25.87 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.12 0.486 . . . . 0.0 110.628 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -99.1 111.35 23.76 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.535 -176.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.79 92.57 2.91 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.504 0.669 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.626 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -131.88 162.62 55.37 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.287 176.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.545 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 11.2 Cg_endo -53.59 -45.28 42.2 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.788 2.326 . . . . 0.0 111.798 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' ASN . . . . . 0.485 ' ND2' ' HB2' ' B' ' 57' ' ' PRO . 0.6 OUTLIER -146.82 73.63 1.32 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.35 179.556 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.443 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 2.4 m -67.13 128.07 35.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.777 -174.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -132.87 73.62 75.48 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.378 174.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.2 162.69 41.71 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.72 2.28 . . . . 0.0 112.842 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -86.27 -76.05 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.243 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -159.87 -175.59 5.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.274 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -127.7 114.23 17.05 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.445 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -138.8 79.81 26.97 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-O 121.231 0.539 . . . . 0.0 109.745 175.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.463 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 66.8 Cg_endo -77.1 150.81 29.88 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.735 2.29 . . . . 0.0 112.345 -178.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 17.0 m -153.57 143.63 22.12 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.338 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.416 ' HB2' HD23 ' B' ' 75' ' ' LEU . 63.1 t80 -104.54 113.4 26.94 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.296 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.448 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.6 OUTLIER -95.57 108.26 20.5 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.502 177.128 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -60.03 -28.35 67.68 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.19 -44.37 64.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.248 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.512 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.4 mt-10 -114.15 3.38 15.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.996 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 8.2 p30 47.8 43.74 17.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.068 0.947 . . . . 0.0 111.453 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.512 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.0 mt -121.93 138.09 53.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.142 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.416 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -100.42 101.68 12.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.463 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -89.19 139.48 30.44 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.511 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.8 mm -91.73 -53.23 9.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.499 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.4 p30 -162.48 -165.99 1.28 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.866 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.63 0.59 69.91 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.686 178.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -92.22 -42.4 9.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.491 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -158.63 153.74 25.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.935 -178.964 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 31.3 t -133.53 150.2 51.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.325 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.4 mm -114.79 105.73 52.88 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.999 0.428 . . . . 0.0 110.95 -174.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.29 136.06 11.12 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.422 2.082 . . . . 0.0 112.599 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.73 146.67 32.25 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.102 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.51 ' HG2' HD12 ' B' ' 89' ' ' ILE . 23.3 Cg_endo -62.49 141.7 87.59 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.459 2.106 . . . . 0.0 111.654 176.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -73.88 -7.06 50.85 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.55 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' ASP . . . . . 0.502 ' OD1' ' HB2' ' B' ' 86' ' ' PRO . 4.6 p-10 -89.29 -4.19 58.23 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.876 0.37 . . . . 0.0 110.781 -178.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.51 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.7 mt -112.29 135.55 51.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.318 179.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -87.21 116.34 29.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.299 0.571 . . . . 0.0 110.19 177.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 54.1 t -121.91 133.56 67.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.293 0.568 . . . . 0.0 111.184 -174.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.27 159.3 42.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.566 177.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.451 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -64.12 -16.67 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.875 -175.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.73 -14.14 49.21 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.025 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -109.31 -22.35 12.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.353 0.597 . . . . 0.0 109.978 -177.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.436 HG22 HG13 ' B' ' 98' ' ' ILE . 85.6 mt -71.4 117.42 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.619 176.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.469 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 26.0 mmmt -112.28 104.7 12.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.677 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.545 HG22 HG23 ' A' ' 10' ' ' VAL . 53.5 mt -108.87 117.89 55.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.198 0.523 . . . . 0.0 111.48 -177.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.679 ' HD1' HG21 ' A' ' 11' ' ' VAL . 96.1 m-85 -127.78 121.96 31.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.451 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 t-80 -104.93 123.13 47.22 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 110.173 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.741 HG22 ' H ' ' B' ' 104' ' ' GLU . 52.4 mt -99.05 120.65 48.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.154 0.502 . . . . 0.0 109.846 175.224 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 102' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' B' ' 102' ' ' ARG . 3.9 ptt180 -75.77 -35.91 59.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.756 -176.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.28 -41.27 66.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.101 0.477 . . . . 0.0 110.53 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.741 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.3 tp10 -81.09 -10.9 59.6 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.397 -178.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 30.5 mmm180 58.57 29.49 18.52 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.11 -178.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.485 HG23 ' HB3' ' B' ' 53' ' ' GLU . 85.4 m -127.08 139.77 52.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.59 -168.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.49 120.64 43.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.521 177.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.494 ' CE2' HD11 ' B' ' 51' ' ' LEU . 23.7 m-85 -101.33 125.29 47.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.714 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.508 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.8 mm -113.64 116.39 52.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.114 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 80.2 m-85 -117.36 124.55 49.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 175.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.661 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.0 mt . . . . . 0 C--O 1.245 0.834 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.592 178.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 112.077 -0.409 . . . . 0.0 112.077 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.48 ' O ' ' HA ' ' B' ' 71' ' ' ALA . 57.7 Cg_endo -71.68 105.82 1.85 Allowed 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.52 2.147 . . . . 0.0 112.566 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.6 p-80 -144.27 21.8 1.71 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 0.0 110.563 178.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -123.46 162.31 23.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.58 -177.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.7 p -132.77 144.55 50.33 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.6 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.413 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.3 m -130.42 142.15 44.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.345 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.41 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -86.93 137.72 32.13 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.684 0.278 . . . . 0.0 110.251 -178.306 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.403 HG12 ' HA ' ' B' ' 67' ' ' SER . 4.5 mm -110.32 120.57 43.87 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -76.81 135.35 15.77 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.243 1.962 . . . . 0.0 112.068 177.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.1 t -85.06 132.93 30.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.605 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.499 HG12 HG13 ' A' ' 13' ' ' VAL . 82.0 t -95.93 112.21 27.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 172.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.523 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 40.7 mt-10 -91.42 110.15 21.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.453 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.499 HG13 HG12 ' A' ' 11' ' ' VAL . 2.5 m -130.31 -176.18 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.662 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -84.09 -30.04 26.3 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -172.78 -178.65 1.92 Allowed 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.158 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.468 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.4 mm? -77.46 150.83 80.09 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-O 120.808 0.337 . . . . 0.0 110.129 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -65.39 172.63 7.48 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.544 2.163 . . . . 0.0 111.535 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.94 139.67 56.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.354 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.21 -15.38 50.86 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.94 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -84.64 173.29 10.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.762 0.315 . . . . 0.0 110.459 176.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -126.89 100.07 6.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.989 0.423 . . . . 0.0 110.826 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.468 ' HB2' HD23 ' A' ' 16' ' ' LEU . 56.7 ttp85 -109.9 147.42 33.43 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.286 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.7 m . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.007 179.154 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo . . . . . 0 N--CA 1.481 0.788 0 N-CA-C 111.304 -0.306 . . . . 0.0 111.304 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 43.1 t-80 -80.63 113.3 18.73 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' B' ' 27' ' ' GLN . 4.1 tp10 67.83 -154.01 0.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.303 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.499 ' H ' ' HG3' ' B' ' 26' ' ' GLU . 2.2 mp0 -92.35 -174.44 3.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.976 0.417 . . . . 0.0 110.491 -177.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' GLN . . . . . 0.414 ' HB3' ' H ' ' B' ' 29' ' ' GLU . 23.8 mm-40 -82.52 -168.69 2.11 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.389 0.614 . . . . 0.0 111.605 176.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 29' ' ' GLU . . . . . 0.414 ' H ' ' HB3' ' B' ' 28' ' ' GLN . 0.3 OUTLIER -104.15 -10.39 17.99 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.239 -0.892 . . . . 0.0 111.384 -175.51 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -84.49 -7.38 59.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.596 -178.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 50.8 t -60.5 111.8 4.6 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.142 -172.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.611 ' HA ' ' OG ' ' B' ' 59' ' ' SER . 76.3 Cg_endo -80.47 130.23 7.85 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.739 2.292 . . . . 0.0 111.706 175.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.452 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 35.1 tt0 -92.92 97.08 10.51 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.348 0.594 . . . . 0.0 109.527 177.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.0 m-85 -83.35 144.05 29.93 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.13 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -120.54 114.43 21.74 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 60.4 t -96.96 129.43 47.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.47 -174.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.419 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -123.0 136.37 54.83 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.744 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.728 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.7 OUTLIER -117.1 127.34 54.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.95 0.405 . . . . 0.0 110.922 -179.274 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.651 ' O ' HD13 ' B' ' 48' ' ' LEU . 7.3 tmtm? -125.42 118.48 25.96 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -175.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.419 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 6.6 mpt_? -90.09 127.12 36.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.257 0.551 . . . . 0.0 111.52 -172.127 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.592 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 25.5 m-85 -109.28 167.74 9.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.86 176.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.92 127.17 9.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.465 174.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 74.56 33.75 55.35 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.472 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.17 172.18 10.77 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.768 -0.254 . . . . 0.0 110.401 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.52 -22.96 65.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.293 0.568 . . . . 0.0 110.5 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.645 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -130.83 142.06 50.37 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.958 178.898 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.504 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.99 -19.21 18.16 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.059 0.457 . . . . 0.0 109.83 -176.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.728 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.0 OUTLIER -143.22 134.74 26.3 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.234 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.401 ' HB2' ' CE1' ' B' ' 41' ' ' PHE . 34.4 ttp180 -113.73 113.0 24.37 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 171.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.583 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.1 mp -108.34 127.86 64.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.8 mm? -110.12 117.96 35.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.282 -177.201 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.93 103.71 13.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 16.5 pt-20 -113.23 153.79 27.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.968 0.413 . . . . 0.0 110.543 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -96.85 112.67 24.32 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.899 -177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -138.43 91.32 2.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.027 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.706 ' HB3' ' OG ' ' B' ' 59' ' ' SER . . . -137.68 162.59 53.77 Favored Pre-proline 0 C--N 1.321 -0.659 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.947 172.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.415 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 25.9 Cg_endo -59.57 -40.62 64.16 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.661 2.241 . . . . 0.0 111.079 172.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -136.67 93.99 2.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.403 -177.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.706 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 58.8 m -119.45 132.54 55.82 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.094 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -132.88 72.97 76.44 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.881 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.0 147.27 23.78 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.693 2.262 . . . . 0.0 112.431 177.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 62' ' ' ASP . . . . . 0.568 ' HB3' ' HE ' ' B' ' 63' ' ' ARG . 9.5 m-20 -103.37 -68.31 0.84 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.452 179.314 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.568 ' HE ' ' HB3' ' B' ' 62' ' ' ASP . 0.4 OUTLIER -160.11 170.05 22.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.905 -0.588 . . . . 0.0 109.904 -179.217 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -116.11 147.21 41.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.665 0.745 . . . . 0.0 110.794 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 19.4 t -142.23 78.96 16.36 Favored Pre-proline 0 C--N 1.305 -1.337 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.803 172.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.415 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 71.9 Cg_endo -78.65 156.64 28.05 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.937 2.425 . . . . 0.0 112.402 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 67' ' ' SER . . . . . 0.473 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 20.3 m -158.51 144.88 17.18 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.229 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.451 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.7 t80 -106.39 119.04 38.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.583 -177.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -100.02 113.47 26.08 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.37 175.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -62.71 -32.09 73.13 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.631 -177.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 2' ' ' PRO . . . -52.62 -50.12 63.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.666 -178.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 3.0 mm-40 -103.6 1.6 32.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.391 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 46.97 46.07 15.67 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 124.375 1.047 . . . . 0.0 111.537 -175.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.7 mt -124.0 138.41 53.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.191 -178.201 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.451 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -104.82 102.26 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.412 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.473 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -88.75 138.6 31.27 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.59 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' ILE . . . . . 0.415 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 34.9 mm -92.3 -46.53 14.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.084 -175.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -150.26 -179.94 7.61 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.65 1.94 60.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.585 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -101.35 -33.97 9.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.626 -0.287 . . . . 0.0 111.146 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -154.4 153.32 31.39 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.309 0.576 . . . . 0.0 112.226 178.543 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 33.1 p -129.73 151.78 49.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.178 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mm -111.9 105.01 56.51 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 120.849 0.357 . . . . 0.0 110.514 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -80.34 135.78 10.91 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.632 2.221 . . . . 0.0 112.713 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -103.14 148.26 35.37 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.17 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.431 ' HG2' HD12 ' B' ' 89' ' ' ILE . 32.6 Cg_endo -66.63 137.73 47.07 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.18 1.92 . . . . 0.0 111.389 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.465 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 0.0 OUTLIER -70.5 -3.99 20.62 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.739 -175.832 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.62 -11.58 58.29 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.465 0.65 . . . . 0.0 109.972 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.431 HD12 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -107.59 132.04 56.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.534 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 57.8 t -82.91 110.59 18.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 175.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 49.1 t -115.34 132.77 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.67 -174.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 92' ' ' ASN . . . . . 0.467 ' OD1' ' HB2' ' B' ' 95' ' ' ASP . 0.1 OUTLIER -141.27 162.2 36.04 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.617 177.481 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.413 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.63 -17.82 63.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.89 -175.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.26 -16.41 40.25 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.794 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 95' ' ' ASP . . . . . 0.467 ' HB2' ' OD1' ' B' ' 92' ' ' ASN . 21.0 t0 -104.57 -23.07 13.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.547 0.689 . . . . 0.0 109.672 -176.04 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.44 114.6 13.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.969 177.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.426 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 24.1 mmmt -108.56 105.96 15.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.808 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 48.9 mt -109.38 116.18 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.373 . . . . 0.0 110.856 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.427 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.7 m-85 -129.39 119.83 24.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -177.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.523 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.8 t-80 -102.62 114.2 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.314 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.552 HG22 ' H ' ' B' ' 104' ' ' GLU . 4.2 mp -95.87 101.14 12.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 171.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -78.5 -15.8 58.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.471 -174.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.44 -41.64 80.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.877 0.37 . . . . 0.0 110.152 175.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.552 ' H ' HG22 ' B' ' 101' ' ' ILE . 13.6 mm-40 -94.32 -3.67 50.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.493 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 59.15 35.78 23.79 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.404 -177.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.424 HG23 ' HB3' ' B' ' 53' ' ' GLU . 27.6 m -125.63 134.75 51.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.982 0.42 . . . . 0.0 110.866 -173.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 49.3 tp -108.63 117.49 34.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.232 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.553 ' CE2' HD11 ' B' ' 51' ' ' LEU . 35.7 m-85 -97.78 129.1 44.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.081 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.58 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 42.2 mm -116.06 123.1 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.961 176.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 83.7 m-85 -121.34 127.54 51.38 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.645 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 65.3 mt . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.594 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.744 0 N-CA-C 111.761 -0.536 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.57 -25.12 77.79 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 123.031 2.487 . . . . 0.0 113.208 -179.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -147.14 -72.28 0.22 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.67 0.271 . . . . 0.0 110.73 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 56.6 ttm -172.68 150.39 2.17 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -176.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.3 p -152.43 132.54 13.49 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.61 0.243 . . . . 0.0 110.423 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.529 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.2 m -127.45 144.37 37.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.676 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -84.98 138.68 32.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.7 mm -107.56 119.85 49.26 Favored Pre-proline 0 C--N 1.321 -0.656 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.119 178.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.38 135.62 24.86 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.557 2.171 . . . . 0.0 112.575 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -93.54 124.23 45.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.566 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.454 HG12 HG13 ' A' ' 13' ' ' VAL . 58.7 t -92.55 118.47 38.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.439 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.8 mt-10 -94.0 111.02 22.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.379 0.609 . . . . 0.0 110.269 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.454 HG13 HG12 ' A' ' 11' ' ' VAL . 2.7 m -127.74 -175.81 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.107 -177.542 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -85.97 -29.75 23.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.519 ' HA ' HG12 ' B' ' 101' ' ' ILE . 13.0 pt-20 -178.28 175.26 1.21 Allowed 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.077 173.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.463 ' H ' HD22 ' A' ' 16' ' ' LEU . 1.8 mm? -71.88 153.62 92.96 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.788 0.327 . . . . 0.0 111.119 -174.001 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.81 173.04 15.1 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.193 1.929 . . . . 0.0 111.446 174.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.25 138.76 57.87 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.619 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.61 -10.46 41.89 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.831 -175.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.4 ' HA ' ' OH ' ' B' ' 46' ' ' TYR . 60.6 m-85 -103.92 152.65 21.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.992 0.425 . . . . 0.0 111.598 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -112.91 104.0 11.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.327 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.626 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 63.7 ttp85 -105.52 149.21 26.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.159 -176.2 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.611 -0.709 . . . . 0.0 109.941 175.559 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo . . . . . 0 N--CA 1.48 0.733 0 N-CA-C 111.251 -0.327 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -139.69 45.44 1.92 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.441 0.638 . . . . 0.0 110.688 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -86.87 -163.55 0.93 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.035 177.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -87.81 142.68 27.62 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' GLN . . . . . 0.546 ' HG3' HG21 ' B' ' 31' ' ' VAL . 3.6 pm0 -107.71 163.34 13.18 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.447 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -148.64 -19.94 0.32 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.143 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -82.11 -7.52 59.62 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.888 0.375 . . . . 0.0 110.892 -176.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.546 HG21 ' HG3' ' B' ' 28' ' ' GLN . 58.6 t -56.25 120.34 34.32 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.467 -177.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.511 ' HA ' ' HB3' ' B' ' 59' ' ' SER . 43.2 Cg_endo -71.68 129.51 15.7 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.419 2.079 . . . . 0.0 112.452 177.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.496 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 41.9 tt0 -102.09 100.6 10.86 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.494 ' HB2' HD21 ' B' ' 81' ' ' LEU . 81.4 m-85 -87.35 155.98 19.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.927 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -130.21 118.06 20.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.961 175.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -95.96 138.89 20.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.822 -174.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.482 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -132.52 151.75 51.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 175.312 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -132.77 141.7 48.64 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 8.7 tmtm? -144.88 135.76 24.74 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.636 -176.22 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.488 ' N ' ' HD2' ' B' ' 40' ' ' ARG . 7.6 mpt_? -98.61 129.48 45.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.995 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.474 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 31.3 m-85 -107.91 146.9 31.73 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.5 177.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -129.37 100.11 5.45 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.903 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 93.39 45.19 3.55 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.203 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -133.45 170.74 15.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.78 -17.04 63.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.281 0.562 . . . . 0.0 110.776 177.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.536 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -130.34 140.16 50.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.538 ' N ' ' HD3' ' B' ' 47' ' ' LYS . 2.8 mppt? -95.28 -24.37 16.8 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.226 0.536 . . . . 0.0 109.668 -174.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.588 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.59 136.76 37.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.249 -177.3 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -120.72 129.58 53.7 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.588 HD11 HD12 ' B' ' 48' ' ' LEU . 2.6 mp -123.03 129.85 74.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.0 mm? -114.26 118.89 35.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.51 -175.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -124.36 103.53 12.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.53 ' HB3' HG23 ' B' ' 106' ' ' THR . 13.1 pt-20 -107.22 153.65 22.38 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.579 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.23 112.46 24.61 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.646 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -136.88 92.82 2.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.37 0.605 . . . . 0.0 110.682 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.661 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -137.89 162.29 55.12 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.178 176.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 25.7 Cg_endo -64.2 -40.36 26.4 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 121.949 1.766 . . . . 0.0 112.591 179.109 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -136.92 36.95 2.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.644 -173.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.661 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 4.6 p -76.01 132.36 40.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.876 0.37 . . . . 0.0 111.937 -177.25 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -135.64 76.96 53.28 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.707 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.8 139.63 44.21 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.382 2.055 . . . . 0.0 111.803 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -91.18 -44.12 9.44 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.761 -177.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -162.68 174.87 11.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.978 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -125.89 133.16 52.0 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.965 175.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.7 p -136.38 79.46 42.25 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.169 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.404 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 91.4 Cg_endo -87.8 153.86 7.37 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.828 2.352 . . . . 0.0 112.391 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 67' ' ' SER . . . . . 0.418 ' HA ' HG12 ' A' ' 8' ' ' ILE . 24.7 m -157.18 150.29 23.74 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.501 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.421 ' HB2' HD23 ' B' ' 75' ' ' LEU . 48.8 t80 -109.05 125.45 52.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.507 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -106.54 117.93 35.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -70.17 -14.92 62.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.828 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.13 -50.94 71.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.101 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.434 ' O ' HD13 ' B' ' 74' ' ' ILE . 6.3 mm-40 -113.36 0.1 14.68 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.307 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' B' ' 85' ' ' LEU . 1.8 p-10 51.35 48.28 23.27 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 124.712 1.257 . . . . 0.0 111.014 -171.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' B' ' 84' ' ' PRO . 0.3 OUTLIER -107.27 146.97 12.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.736 177.671 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.427 ' HB2' HD11 ' B' ' 85' ' ' LEU . 3.2 tm? -115.72 102.38 9.68 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.1 OUTLIER -91.07 139.93 30.3 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -178.565 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.0 mm -93.25 -46.42 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.618 -174.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.429 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.2 t-20 -161.93 178.59 8.75 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -175.006 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.17 32.83 1.31 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.195 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 80' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' B' ' 78' ' ' ASN . 28.2 mmmt -125.07 -44.66 1.9 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.494 HD21 ' HB2' ' B' ' 34' ' ' TYR . 1.0 OUTLIER -152.25 153.65 34.18 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.784 -177.978 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 13.3 p -126.52 145.82 50.36 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.055 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.6 mm -107.83 111.07 62.55 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.603 -178.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.602 ' HA ' HD12 ' B' ' 74' ' ' ILE . 59.8 Cg_endo -75.69 132.8 14.88 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.992 1.795 . . . . 0.0 111.899 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 78.7 mt -102.6 148.26 35.25 Favored Pre-proline 0 C--N 1.323 -0.561 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.773 -176.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.93 142.93 43.89 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.739 2.293 . . . . 0.0 112.327 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.431 ' HD2' ' N ' ' B' ' 87' ' ' ARG . 9.1 mpt_? -79.07 -6.48 56.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.931 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -79.52 -18.83 51.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.639 0.733 . . . . 0.0 109.714 179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 55.8 mt -107.56 131.5 57.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.773 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.2 115.83 27.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 91' ' ' VAL . . . . . 0.411 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -126.24 134.85 65.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.324 0.583 . . . . 0.0 111.222 -173.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.79 164.91 28.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.855 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.529 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.77 -16.85 62.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.867 -175.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.48 -12.41 43.08 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.177 0.513 . . . . 0.0 110.905 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -109.24 -26.87 9.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.951 -176.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 96' ' ' ILE . . . . . 0.406 HG22 HG13 ' B' ' 98' ' ' ILE . 82.5 mt -69.79 114.98 7.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.04 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.414 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.1 mmmt -108.45 103.42 12.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.401 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.428 HD12 ' HB ' ' A' ' 8' ' ' ILE . 40.4 mt -107.14 121.51 60.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.796 179.164 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.436 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 76.3 m-85 -134.56 121.2 20.61 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.275 -178.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.439 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 17.5 t-80 -96.34 110.75 23.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.463 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.811 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.2 mp -91.87 107.55 18.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 173.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -73.85 -23.19 59.58 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.971 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -60.64 -47.59 85.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.164 0.507 . . . . 0.0 110.643 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.811 ' H ' HG22 ' B' ' 101' ' ' ILE . 15.6 mm-40 -92.61 -3.42 55.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.641 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 57.99 34.39 24.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.128 -176.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.53 HG23 ' HB3' ' B' ' 53' ' ' GLU . 41.2 m -129.16 141.6 51.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.201 -170.213 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.8 tp -107.12 120.31 41.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.007 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.706 ' CD1' HD13 ' B' ' 101' ' ' ILE . 21.2 m-85 -102.6 130.61 49.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.014 -178.023 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.571 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.5 mm -115.49 120.23 64.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.9 177.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.441 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.7 m-85 -121.01 126.66 50.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.536 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.646 -0.692 . . . . 0.0 109.82 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.845 0 N-CA-C 112.096 -0.401 . . . . 0.0 112.096 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.83 29.58 0.47 Allowed 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.083 2.522 . . . . 0.0 113.774 -177.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -177.45 -70.86 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.866 0.365 . . . . 0.0 110.097 176.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.4 tpt -159.55 133.35 7.33 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -178.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 2.0 m -149.43 145.16 26.79 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.515 HG21 ' HB2' ' B' ' 93' ' ' ALA . 24.4 m -135.33 152.87 32.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.705 0.288 . . . . 0.0 110.647 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.76 138.38 34.41 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.6 mm -111.86 121.26 40.15 Favored Pre-proline 0 C--N 1.323 -0.565 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.311 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.64 130.34 18.09 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.05 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.468 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -100.77 127.1 54.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.188 0.518 . . . . 0.0 110.667 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.565 HG12 HG13 ' A' ' 13' ' ' VAL . 83.0 t -95.5 123.07 47.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.128 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.2 mt-10 -92.19 109.69 21.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.479 0.657 . . . . 0.0 110.514 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.565 HG13 HG12 ' A' ' 11' ' ' VAL . 3.5 m -126.22 -176.12 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.423 -176.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -91.27 -25.64 19.38 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.436 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.5 pt-20 -171.51 170.54 5.75 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.75 176.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.478 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.1 mm? -74.1 151.63 88.26 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.521 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -59.41 171.54 2.44 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.374 2.049 . . . . 0.0 111.81 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.74 130.67 42.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.044 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.86 -6.33 29.32 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.375 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.76 164.45 14.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.923 0.392 . . . . 0.0 111.363 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -115.83 97.36 6.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.363 -177.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.498 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 35.1 ttp85 -101.76 145.69 28.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.424 -175.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 C--O 1.251 1.184 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.386 178.984 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.478 0.564 0 N-CA-C 110.858 -0.478 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -96.86 -29.46 13.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.413 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.9 mm-40 -88.1 -163.75 1.0 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.875 -176.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.19 142.38 58.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.376 0.608 . . . . 0.0 111.109 -177.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' GLN . . . . . 0.407 ' HB3' ' OD1' ' B' ' 30' ' ' ASP . 28.3 mt-30 -72.63 153.76 41.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.0 -178.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -82.56 -16.16 49.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.627 -175.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' ASP . . . . . 0.423 ' HB2' ' HD3' ' B' ' 60' ' ' LYS . 5.5 p-10 -87.26 2.05 51.32 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.892 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 66.0 t -74.04 115.71 45.24 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.621 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.501 ' HB3' HD22 ' B' ' 54' ' ' ASN . 17.8 Cg_endo -62.86 138.96 71.67 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.72 2.28 . . . . 0.0 112.843 -176.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.653 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 23.8 tt0 -93.8 100.99 13.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.084 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.529 ' HB2' HD21 ' B' ' 81' ' ' LEU . 77.4 m-85 -88.09 142.71 27.56 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.297 176.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -122.58 112.03 17.5 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.43 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 56.9 t -96.93 136.67 26.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.027 -171.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 9.0 mptt -132.52 132.62 42.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 174.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 38' ' ' MET . . . . . 0.565 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -113.57 138.82 49.61 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.473 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.542 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 9.8 tmtm? -143.49 136.63 27.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.948 0.404 . . . . 0.0 110.706 -176.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -100.95 135.94 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.825 -177.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 41' ' ' PHE . . . . . 0.542 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.6 m-85 -111.83 155.73 23.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.987 0.422 . . . . 0.0 110.709 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -127.21 119.25 25.97 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.968 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 63.41 46.98 91.4 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.415 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -126.57 171.04 11.44 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.58 -2.74 18.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.96 0.409 . . . . 0.0 111.101 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' TYR . . . . . 0.535 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.2 OUTLIER -150.06 128.15 11.95 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.913 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -84.49 -28.54 26.69 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.216 -173.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.638 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -133.59 135.78 44.49 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.65 -178.403 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -121.39 125.28 46.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.527 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' ILE . . . . . 0.638 HD11 HD12 ' B' ' 48' ' ' LEU . 1.8 mp -122.26 129.47 75.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.646 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -111.99 114.88 28.03 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.633 -178.119 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.18 104.53 14.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.459 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 14.9 pt-20 -108.41 153.08 23.8 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.339 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 54' ' ' ASN . . . . . 0.501 HD22 ' HB3' ' B' ' 32' ' ' PRO . 33.0 t-20 -97.3 110.33 22.9 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.528 -179.343 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -137.32 91.59 2.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.086 0.47 . . . . 0.0 110.815 178.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 56' ' ' ALA . . . . . 0.653 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -138.42 156.19 73.53 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.534 176.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.18 -38.56 85.46 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.479 2.119 . . . . 0.0 111.495 176.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -132.68 73.33 1.52 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.345 -177.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 59' ' ' SER . . . . . 0.566 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 19.8 m -88.15 122.14 31.37 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.335 -178.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.423 ' HD3' ' HB2' ' B' ' 30' ' ' ASP . 27.6 mtpp -130.34 73.86 80.87 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.848 175.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.93 137.89 17.99 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.419 2.079 . . . . 0.0 111.726 174.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -92.67 -62.64 1.35 Allowed 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.669 -177.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -159.24 172.17 18.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.956 -178.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -124.94 129.65 50.78 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.591 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 10.9 m -135.33 78.97 50.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' PRO . . . . . 0.472 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.3 Cg_endo -77.19 149.18 27.95 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.312 2.008 . . . . 0.0 112.088 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.7 m -154.28 141.89 19.86 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.239 -179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.456 ' HB2' HD23 ' B' ' 75' ' ' LEU . 43.1 t80 -105.74 113.06 26.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.311 -178.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' ASN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 0.5 OUTLIER -95.63 106.1 18.16 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 176.253 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -56.42 -34.07 66.42 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.335 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.72 -45.21 58.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.859 -176.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 72' ' ' GLU . . . . . 0.523 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.0 mt-10 -112.31 5.31 18.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.096 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' ASN . . . . . 0.452 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.6 p-10 48.86 42.31 19.99 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.755 1.284 . . . . 0.0 111.6 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.523 HG13 ' O ' ' B' ' 72' ' ' GLU . 65.7 mt -118.75 135.77 58.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.168 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.456 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -103.67 102.99 12.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.472 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -89.75 141.47 28.59 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -178.737 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 43.2 mm -97.97 -45.75 12.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.863 -176.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.406 ' OD1' ' HG2' ' B' ' 80' ' ' LYS . 3.3 t-20 -156.53 176.48 12.65 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.013 -172.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.14 2.4 44.02 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' LYS . . . . . 0.406 ' HG2' ' OD1' ' B' ' 78' ' ' ASN . 44.1 mmtm -89.22 -43.94 10.63 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 81' ' ' LEU . . . . . 0.529 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -157.0 153.46 28.03 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.495 0.664 . . . . 0.0 112.495 -176.258 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 15.8 p -124.28 146.91 48.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.812 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -108.18 102.35 45.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 120.888 0.375 . . . . 0.0 110.774 -177.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.46 ' HA ' HG12 ' B' ' 74' ' ' ILE . 60.5 Cg_endo -75.81 126.09 9.22 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.213 1.942 . . . . 0.0 112.127 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 83.5 mt -92.63 154.92 42.38 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.465 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 86' ' ' PRO . . . . . 0.436 ' HG2' HD12 ' B' ' 89' ' ' ILE . 39.3 Cg_endo -68.53 138.49 42.15 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 111.877 176.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 87' ' ' ARG . . . . . 0.452 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.1 mpt_? -80.69 -0.2 37.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -87.68 -10.35 51.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.386 0.612 . . . . 0.0 110.362 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' ILE . . . . . 0.516 ' CD1' HD23 ' B' ' 48' ' ' LEU . 57.4 mt -112.47 137.77 44.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.196 -175.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 64.6 t -83.19 111.73 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.917 177.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 92.7 t -118.69 131.32 71.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.597 0.713 . . . . 0.0 111.652 -174.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.35 159.89 41.34 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.228 176.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.515 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -64.64 -14.79 59.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.12 0.486 . . . . 0.0 111.55 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.12 -26.19 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.077 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.38 -26.27 14.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.991 0.424 . . . . 0.0 110.582 -178.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 89.6 mt -69.0 113.4 4.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.764 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -110.41 108.15 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.875 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 98' ' ' ILE . . . . . 0.468 HG22 HG23 ' A' ' 10' ' ' VAL . 50.7 mt -111.92 116.39 52.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.85 0.357 . . . . 0.0 110.861 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 99' ' ' PHE . . . . . 0.409 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.3 m-85 -128.62 119.09 24.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.471 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 100' ' ' HIS . . . . . 0.475 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 13.1 t-80 -98.07 110.21 22.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.575 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 101' ' ' ILE . . . . . 0.636 HG22 ' H ' ' B' ' 104' ' ' GLU . 61.1 mt -91.28 104.57 15.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.649 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 102' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' B' ' 100' ' ' HIS . 20.7 mtm180 -76.12 -28.24 57.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.895 -177.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -59.9 -42.16 93.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.798 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.636 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.0 tp10 -99.05 -0.93 40.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.174 -177.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 58.61 30.24 19.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.788 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 106' ' ' THR . . . . . 0.4 HG23 ' HB3' ' B' ' 53' ' ' GLU . 28.0 m -127.99 139.22 52.69 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.016 0.436 . . . . 0.0 111.155 -172.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.8 tp -109.05 120.23 41.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.296 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 108' ' ' TYR . . . . . 0.646 ' CE2' HD11 ' B' ' 51' ' ' LEU . 31.5 m-85 -102.08 127.0 49.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 109' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 32.6 mm -113.87 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.798 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 110' ' ' TYR . . . . . 0.489 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.0 m-85 -122.32 126.5 48.22 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.535 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 55.4 mt . . . . . 0 C--O 1.245 0.865 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.309 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 1.5 m . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' B' ' 93' ' ' ALA . 17.5 m -119.57 143.1 32.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 120.829 0.347 . . . . 0.0 110.795 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.41 137.4 33.41 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.4 mm -105.41 121.05 47.49 Favored Pre-proline 0 C--N 1.319 -0.747 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.101 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.86 125.71 12.96 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.196 1.931 . . . . 0.0 111.956 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.492 HG23 HG22 ' B' ' 98' ' ' ILE . 2.2 p -103.31 127.98 56.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.551 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.566 HG12 HG13 ' A' ' 13' ' ' VAL . 44.2 t -95.04 125.17 47.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.816 178.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.455 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 35.3 mt-10 -93.25 96.05 9.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.637 0.732 . . . . 0.0 110.428 178.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.593 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 5.0 m -107.27 177.49 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.208 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.09 -14.02 24.61 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' HA ' HG12 ' B' ' 101' ' ' ILE . 12.9 pt-20 -178.61 166.83 1.77 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.596 -1.183 . . . . 0.0 109.677 173.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.1 mm? -73.73 149.6 88.21 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.532 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.03 168.18 21.35 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.432 2.088 . . . . 0.0 111.516 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.23 140.22 57.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -24.31 18.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.688 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -86.06 164.32 17.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.016 0.436 . . . . 0.0 111.087 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.59 95.49 5.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.645 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.524 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.4 ttt-85 . . . . . 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.0 178.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 . . . . . 0 N--CA 1.445 -0.724 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.468 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 83.5 m-85 -89.86 152.82 21.07 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -129.65 119.05 22.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 51.9 t -97.48 132.12 42.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.533 -175.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -125.88 132.91 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 176.187 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.649 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.7 ttt -118.14 139.34 51.4 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.505 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.509 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.3 tmtp? -144.9 132.73 21.19 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.309 -175.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.468 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -94.3 134.12 37.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.265 -176.55 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.509 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.9 m-85 -121.55 134.98 55.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.804 179.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -116.22 118.82 33.85 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.499 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.21 19.76 62.0 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.386 175.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -108.62 172.07 7.06 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 122.709 -0.289 . . . . 0.0 110.492 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.82 -20.37 63.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.343 0.592 . . . . 0.0 110.434 176.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.613 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -128.87 141.57 51.24 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.561 177.73 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -98.05 -21.45 16.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.229 0.537 . . . . 0.0 109.622 -176.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.649 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.09 132.83 29.02 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.235 -179.176 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 31.9 ttp180 -114.71 121.23 42.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.554 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.4 mp -118.52 128.54 75.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.549 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.3 mm? -114.98 121.09 42.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.442 -177.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -125.31 104.25 13.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.5 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.8 pt-20 -107.06 153.36 22.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.982 0.42 . . . . 0.0 110.614 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.14 107.41 19.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.129 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -130.05 93.78 3.57 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.458 0.647 . . . . 0.0 110.346 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.791 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.505 -179.412 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 . . . . . 0 N--CA 1.448 -0.536 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 16.0 m -129.95 79.89 72.25 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-O 121.153 0.502 . . . . 0.0 109.778 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.442 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 63.9 Cg_endo -79.68 150.41 21.49 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 111.784 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . 0.506 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 14.1 m -154.03 142.38 20.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.491 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.415 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 59.7 t80 -104.56 118.47 36.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.493 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.475 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.0 OUTLIER -100.05 115.27 29.35 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.748 177.119 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -64.25 -28.2 69.57 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.506 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.75 -46.63 70.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.407 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.499 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -112.46 2.44 16.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.568 -177.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . 0.444 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.1 p-10 48.37 45.56 20.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.38 1.072 . . . . 0.0 111.822 -175.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.499 HG13 ' O ' ' B' ' 72' ' ' GLU . 66.9 mt -124.07 137.95 55.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.152 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.412 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -102.9 104.21 14.43 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.5 p90 -93.07 142.1 27.67 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.84 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.1 mm -88.24 -54.02 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 -177.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 41.3 m-20 -153.25 176.91 11.43 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.3 40.63 1.75 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.56 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . 0.639 ' HD3' ' O ' ' B' ' 80' ' ' LYS . 0.0 OUTLIER -131.23 -36.53 1.3 Allowed 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.517 ' HG ' ' HG3' ' B' ' 80' ' ' LYS . 0.2 OUTLIER -154.53 153.53 31.61 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.441 0.638 . . . . 0.0 111.704 175.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 21.2 p -130.47 148.99 52.34 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.274 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mm -107.84 102.53 45.79 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 120.819 0.342 . . . . 0.0 110.178 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.85 135.13 17.2 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.208 1.939 . . . . 0.0 112.117 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -97.59 141.09 22.47 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.559 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -64.76 139.62 63.77 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.986 1.791 . . . . 0.0 110.761 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.444 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.6 mpt_? -70.82 -0.99 10.2 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.789 -174.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -79.28 -16.79 55.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.534 0.683 . . . . 0.0 109.714 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -110.04 137.1 43.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.6 p -92.32 112.37 25.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . 0.415 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.5 p -121.38 139.32 48.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.306 0.574 . . . . 0.0 111.218 -174.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.582 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.5 164.69 29.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.011 -178.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.451 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -59.83 -23.53 63.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.058 0.456 . . . . 0.0 111.577 -176.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.06 -16.48 43.63 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.279 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.582 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.7 t70 -102.51 -24.27 13.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.683 0.754 . . . . 0.0 109.563 -176.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.442 HG22 HG13 ' B' ' 98' ' ' ILE . 81.3 mt -72.78 115.55 13.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.306 177.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.461 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -109.47 106.49 16.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.718 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.492 HG22 HG23 ' A' ' 10' ' ' VAL . 57.2 mt -110.99 121.14 63.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.447 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -134.54 124.43 25.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.367 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.455 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 22.5 t-80 -105.5 113.09 26.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.715 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.593 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 3.0 mp -89.37 118.39 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 175.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 62.8 mtp85 -81.76 -23.71 36.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.866 -177.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -57.94 -43.33 86.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.14 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.512 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.0 pt-20 -110.0 0.98 18.72 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.456 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 58.27 38.49 26.08 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.63 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.5 HG23 ' HB3' ' B' ' 53' ' ' GLU . 29.1 m -117.73 137.92 52.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 120.921 0.391 . . . . 0.0 110.674 -176.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.25 114.35 28.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.875 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.549 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.2 m-85 -93.48 125.44 38.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.377 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.542 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 44.0 mm -115.04 121.95 68.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.109 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.461 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.0 m-85 -121.8 127.83 51.02 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.613 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.3 mt . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.783 -0.627 . . . . 0.0 109.767 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.0 p . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.496 HG21 ' HB2' ' B' ' 93' ' ' ALA . 20.3 m -122.51 141.01 44.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.748 -176.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.434 ' HA ' ' CB ' ' B' ' 67' ' ' SER . 0.3 OUTLIER -88.19 138.03 31.81 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.061 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.572 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.0 mm -107.59 120.92 45.87 Favored Pre-proline 0 C--N 1.317 -0.827 0 C-N-CA 120.634 -0.427 . . . . 0.0 109.887 -176.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.12 130.63 21.84 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.503 2.135 . . . . 0.0 112.469 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.9 t -89.67 131.84 35.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.645 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.444 ' HB ' ' CD2' ' B' ' 99' ' ' PHE . 47.6 t -97.48 111.22 26.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 172.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.493 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.5 mt-10 -92.64 107.19 19.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.629 0.728 . . . . 0.0 110.789 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.4 m -135.43 -174.33 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.299 -177.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.523 ' OD1' ' HB2' ' B' ' 103' ' ' LYS . 24.5 m-20 -105.61 -10.07 17.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.887 0.375 . . . . 0.0 110.547 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -165.19 156.28 14.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.687 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.481 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -84.77 156.2 61.45 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.702 0.287 . . . . 0.0 110.722 -179.1 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -54.88 170.55 0.61 Allowed 'Trans proline' 0 C--O 1.238 0.501 0 C-N-CA 123.464 2.776 . . . . 0.0 113.161 172.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.24 142.22 58.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.397 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.56 -9.7 66.7 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.24 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -88.11 147.1 25.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.274 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -101.38 102.89 13.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.434 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.481 ' HD2' HD22 ' A' ' 16' ' ' LEU . 14.5 ttt180 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.049 -172.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 121.381 0.61 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.6 m-85 -84.28 154.48 22.95 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.529 176.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -123.59 113.7 19.04 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -95.45 131.43 42.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.984 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.55 142.95 51.24 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.567 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -124.26 140.64 52.77 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.015 -0.274 . . . . 0.0 110.582 -176.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.9 tmtp? -145.3 133.82 22.0 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.704 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.473 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.92 137.49 34.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.713 179.366 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -117.54 150.67 38.58 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -125.27 111.17 14.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.958 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.59 54.52 6.62 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.584 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.81 171.45 14.48 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 174.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.78 66.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.687 0.756 . . . . 0.0 110.206 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.692 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -124.84 135.56 53.03 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.923 -178.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.5 mppt? -96.07 -23.53 16.75 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.619 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -136.66 130.3 31.97 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.735 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -118.63 123.46 45.04 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.836 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.619 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -120.04 130.85 73.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.73 119.95 38.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -123.74 103.48 12.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.517 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -108.86 153.7 23.15 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.693 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . 0.412 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -100.52 114.43 28.05 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.501 -178.866 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.56 ' HD3' ' O ' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -137.61 90.95 2.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.664 0.745 . . . . 0.0 111.318 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.711 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.63 177.141 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 . . . . . 0 CA--C 1.517 -0.316 0 CA-C-O 120.727 0.298 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 11.5 t -135.61 79.86 46.08 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.67 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 66.2 Cg_endo -87.9 160.43 7.47 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.068 2.512 . . . . 0.0 113.168 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . 0.434 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 38.8 p -161.96 144.44 11.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.731 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.419 ' HB2' HD23 ' B' ' 75' ' ' LEU . 57.2 t80 -103.47 119.58 39.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.787 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -100.58 116.06 31.63 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.503 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -66.98 -24.91 66.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.891 -176.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.01 -43.26 86.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.708 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.457 ' O ' HG13 ' B' ' 74' ' ' ILE . 10.3 mt-10 -112.45 4.76 17.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . 0.412 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.4 p-10 48.24 43.14 18.67 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 124.524 1.14 . . . . 0.0 111.067 -176.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.457 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.5 mt -119.25 134.67 62.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.269 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.419 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.5 tm? -102.92 103.34 13.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.431 ' HB2' ' HB3' ' B' ' 82' ' ' SER . 0.0 OUTLIER -88.8 144.91 25.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -178.173 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . 0.421 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 42.5 mm -98.51 -57.45 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.155 0.502 . . . . 0.0 110.927 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -147.07 179.06 7.89 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.22 4.76 10.72 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.286 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -93.86 -45.1 7.79 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -151.8 153.23 33.85 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.557 0.694 . . . . 0.0 112.452 -177.464 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' B' ' 76' ' ' TYR . 10.6 p -126.47 147.43 49.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.891 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 52.1 mm -106.83 109.12 62.93 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.936 0.398 . . . . 0.0 110.751 -177.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.416 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.9 Cg_endo -81.49 137.15 10.18 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.262 1.974 . . . . 0.0 112.024 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.91 150.18 36.83 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.949 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.463 ' HG2' HD12 ' B' ' 89' ' ' ILE . 28.6 Cg_endo -63.22 142.15 85.26 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.537 2.158 . . . . 0.0 111.552 176.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.412 ' NE ' HD21 ' B' ' 73' ' ' ASN . 10.0 mpt_? -79.19 -2.83 42.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.069 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.33 2.33 56.7 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.786 0.327 . . . . 0.0 111.083 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.463 HD12 ' HG2' ' B' ' 86' ' ' PRO . 58.1 mt -121.95 138.28 52.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.506 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.26 122.91 38.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 52.3 t -126.14 130.16 72.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.207 0.527 . . . . 0.0 111.299 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.618 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.31 161.44 37.89 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.725 177.427 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.496 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -65.45 -12.6 54.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.201 -175.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.62 -9.23 47.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.213 0.53 . . . . 0.0 110.882 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.618 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 12.7 t70 -111.75 -24.82 9.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.673 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.3 mt -73.08 115.06 13.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.949 176.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.458 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.9 mmmm -111.35 101.92 10.35 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.949 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.572 HD12 ' HB ' ' A' ' 8' ' ' ILE . 32.8 mt -101.85 122.6 54.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 111.343 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.444 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 70.7 m-85 -133.21 118.13 18.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.252 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.493 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 20.2 t-80 -100.4 107.78 19.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.821 0.343 . . . . 0.0 110.495 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.63 HD12 ' CE1' ' B' ' 108' ' ' TYR . 49.8 mt -86.85 102.56 12.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.18 0.514 . . . . 0.0 110.021 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -17.34 63.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.658 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . 0.523 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 30.8 tttm -67.19 -48.91 66.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.998 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.606 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.4 mm-40 -101.32 4.93 42.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.159 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? 55.28 37.08 28.36 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.652 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 40.0 m -125.25 130.6 52.39 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.066 -174.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.54 117.69 33.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.629 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.63 ' CE1' HD12 ' B' ' 101' ' ' ILE . 10.1 m-85 -95.99 124.39 39.98 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.113 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.571 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.1 mm -114.81 115.92 50.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.869 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.505 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.3 m-85 -116.4 125.11 51.58 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 176.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.692 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 58.7 mt . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.94 -0.552 . . . . 0.0 109.741 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.438 HG21 ' HB2' ' B' ' 93' ' ' ALA . 19.7 m -130.81 145.89 34.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.941 0.4 . . . . 0.0 110.891 -177.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 136.15 33.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.899 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.459 ' HB ' HD12 ' B' ' 98' ' ' ILE . 6.5 mm -105.19 121.08 47.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.309 -178.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.03 130.53 15.58 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.433 2.089 . . . . 0.0 112.26 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.409 HG13 HG22 ' B' ' 98' ' ' ILE . 46.4 t -86.95 133.3 30.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.576 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.511 HG12 HG13 ' A' ' 13' ' ' VAL . 98.9 t -98.01 119.94 46.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 173.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.415 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 28.8 mt-10 -93.18 111.99 23.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.566 0.698 . . . . 0.0 110.697 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.511 HG13 HG12 ' A' ' 11' ' ' VAL . 4.8 m -129.6 170.46 18.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.535 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -91.61 -20.24 21.86 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -168.76 155.9 7.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.12 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.446 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -78.7 149.32 74.3 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -67.56 172.23 10.71 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.328 2.019 . . . . 0.0 111.44 177.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.74 135.86 57.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.163 0.506 . . . . 0.0 111.439 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.0 -17.26 27.31 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.793 -175.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -94.06 146.73 23.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.939 0.4 . . . . 0.0 111.074 178.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -101.27 95.22 6.38 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.103 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HD2' HD22 ' A' ' 16' ' ' LEU . 18.3 ttt180 . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.841 -178.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.48 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 29.9 tt0 . . . . . 0 N--CA 1.446 -0.636 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.541 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 92.5 m-85 -90.47 142.03 28.15 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.692 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.443 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 35.2 tt0 -112.4 107.15 15.84 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.57 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.6 p -94.91 127.26 47.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.261 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.443 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -124.26 121.44 35.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.572 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.5 ttt -107.65 139.11 42.7 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 -175.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.548 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 8.4 tmtm? -144.54 134.87 24.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.853 0.358 . . . . 0.0 110.515 -174.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.509 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -94.76 134.17 37.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -178.808 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.548 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 34.5 m-85 -119.15 139.4 51.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.985 0.422 . . . . 0.0 111.128 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -130.41 116.29 18.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.597 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 90.82 32.27 9.29 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.95 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.79 170.85 13.35 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.43 64.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.401 0.619 . . . . 0.0 110.448 177.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.566 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.3 p90 -126.97 147.58 50.11 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.795 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.509 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.9 mppt? -104.57 -18.62 14.27 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.24 0.543 . . . . 0.0 109.742 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.629 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.83 133.34 31.9 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.398 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -119.77 131.12 55.26 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.629 HD11 HD12 ' B' ' 48' ' ' LEU . 1.9 mp -128.19 128.45 68.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.581 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.9 mm? -111.55 119.92 40.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.1 mp -126.88 104.07 12.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.541 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -111.43 153.76 25.65 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.942 0.401 . . . . 0.0 110.55 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.06 100.32 11.46 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.488 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.415 ' HD3' ' HB2' ' B' ' 35' ' ' GLU . 18.4 ptmt -129.28 93.5 3.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.6 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . 0.48 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.321 -0.669 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.106 176.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . 0.404 ' CD1' HD12 ' B' ' 107' ' ' LEU . 72.9 m-85 . . . . . 0 N--CA 1.453 -0.318 0 CA-C-O 120.655 0.264 . . . . 0.0 110.546 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.3 m -133.02 79.21 63.42 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 176.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -83.29 153.38 14.07 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.78 2.32 . . . . 0.0 112.436 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.2 m -156.65 145.95 20.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.213 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.448 ' HB2' HD23 ' B' ' 75' ' ' LEU . 49.8 t80 -108.34 124.42 50.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.599 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -105.28 116.71 32.41 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.646 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -66.7 -25.89 66.76 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.687 -176.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.8 -50.99 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.547 -178.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.9 mt-10 -112.68 7.56 18.71 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.486 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 50.66 42.73 27.51 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 124.268 0.98 . . . . 0.0 111.429 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 68.1 mt -117.75 138.07 49.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.457 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.448 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -105.03 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.49 140.17 29.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.7 mm -92.85 -57.06 4.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.958 -176.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' B' ' 80' ' ' LYS . 57.8 m-20 -151.95 -177.81 6.37 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -178.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.19 20.93 2.94 Favored Glycine 0 C--O 1.225 -0.409 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.964 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . 0.415 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.7 mmtt -110.62 -38.36 5.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -160.47 153.36 21.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.876 178.052 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.2 t -127.92 150.37 49.91 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.584 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mm -114.81 100.81 53.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.952 0.405 . . . . 0.0 111.045 -175.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.408 ' HA ' HG12 ' B' ' 74' ' ' ILE . 21.4 Cg_exo -67.92 136.55 38.67 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.712 2.275 . . . . 0.0 112.33 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 63.6 mt -103.65 153.82 38.37 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.092 -178.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.447 ' HG2' HD12 ' B' ' 89' ' ' ILE . 46.4 Cg_endo -72.33 138.69 30.63 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.125 1.883 . . . . 0.0 111.787 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 1.8 mmt180 -74.9 2.18 10.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.804 -177.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -86.91 -18.41 30.88 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.415 0.626 . . . . 0.0 110.053 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.447 HD12 ' HG2' ' B' ' 86' ' ' PRO . 66.7 mt -104.38 134.01 46.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.303 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 48.3 t -82.46 111.57 19.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.85 130.93 73.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.324 0.583 . . . . 0.0 111.461 -172.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.576 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.82 163.36 33.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.358 175.137 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.438 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.21 -19.01 64.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.913 0.387 . . . . 0.0 111.799 -177.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.3 -13.3 55.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.961 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.576 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 23.3 t0 -109.04 -20.69 12.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.573 0.701 . . . . 0.0 109.881 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.418 HG22 HG13 ' B' ' 98' ' ' ILE . 80.3 mt -76.73 116.27 19.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.786 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.5 mmmt -109.62 104.07 13.03 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.254 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.459 HD12 ' HB ' ' A' ' 8' ' ' ILE . 49.1 mt -107.82 121.38 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -130.71 121.12 24.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.257 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.415 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 30.1 t-80 -104.5 114.76 29.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.898 0.38 . . . . 0.0 110.597 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.518 HG22 ' H ' ' B' ' 104' ' ' GLU . 58.7 mt -90.96 100.55 11.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -69.69 -24.48 63.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.148 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -59.23 -47.92 83.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.321 0.581 . . . . 0.0 110.494 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.518 ' H ' HG22 ' B' ' 101' ' ' ILE . 13.7 mm-40 -100.88 0.79 39.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.819 -175.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 57.1 33.5 23.42 Favored 'General case' 0 N--CA 1.46 0.072 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.66 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.418 ' CG2' HD12 ' B' ' 51' ' ' LEU . 46.1 m -119.62 130.13 54.95 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -174.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . 0.406 HD21 ' CG2' ' B' ' 98' ' ' ILE . 0.5 OUTLIER -102.27 121.27 41.94 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.03 178.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.581 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.7 m-85 -98.97 126.79 44.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.155 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.511 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.3 mm -115.36 121.4 67.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.899 175.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 82.2 m-85 -122.55 124.32 43.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.566 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.819 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.901 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.3 p . . . . . 0 N--CA 1.45 -0.46 0 CA-C-O 120.92 0.39 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -125.84 142.63 41.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.324 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.51 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -91.5 140.05 30.12 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.352 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.5 mm -110.35 123.52 35.67 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 -176.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -71.39 125.51 11.35 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.077 1.851 . . . . 0.0 111.979 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.486 HG23 HG22 ' B' ' 98' ' ' ILE . 1.9 p -97.65 119.96 46.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 13' ' ' VAL . 61.5 t -91.29 117.13 33.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -84.72 111.91 20.01 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.325 0.583 . . . . 0.0 110.271 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.559 HG13 HG12 ' A' ' 11' ' ' VAL . 3.3 m -124.55 -174.77 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.58 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -93.73 -26.77 16.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -171.14 167.19 7.16 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.344 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.494 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.3 mm? -71.04 143.49 88.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.636 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.92 174.48 11.15 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.928 2.419 . . . . 0.0 112.259 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.85 139.77 12.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.459 178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.16 -9.42 57.85 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.429 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -102.86 167.52 9.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.991 0.424 . . . . 0.0 111.953 -179.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -127.53 98.92 5.39 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.575 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' HB2' HD23 ' A' ' 16' ' ' LEU . 26.5 ttp85 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.4 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 . . . . . 0 N--CA 1.447 -0.586 0 CA-C-O 121.255 0.55 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 79.1 m-85 -85.76 145.16 27.37 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.029 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -123.47 112.75 17.88 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.634 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -100.83 131.39 48.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.694 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -120.81 150.51 40.91 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.581 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.3 ttt -135.63 134.49 39.31 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -176.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 10.2 tmtt? -142.83 132.55 23.94 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.996 -0.281 . . . . 0.0 110.527 -172.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.477 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.5 OUTLIER -95.01 133.01 39.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.132 0.492 . . . . 0.0 111.006 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.407 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 14.3 m-85 -111.85 140.33 46.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.012 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -118.4 121.97 41.64 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.275 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.01 46.54 43.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.638 -179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.09 170.94 14.26 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.49 -14.41 62.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.106 0.479 . . . . 0.0 110.768 178.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -134.82 137.69 43.56 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.611 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.531 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 3.0 mppt? -96.32 -23.2 16.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.519 . . . . 0.0 109.841 -173.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.581 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.35 133.51 34.96 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.448 -176.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -119.31 122.46 41.92 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.569 ' CD1' HD12 ' B' ' 48' ' ' LEU . 2.4 mp -117.4 131.56 69.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.634 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 3.4 mm? -117.52 118.03 31.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 -176.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -122.71 103.74 13.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.9 pt-20 -110.42 153.41 25.03 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.371 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -102.12 108.82 20.36 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.365 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -134.01 92.84 3.01 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.651 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.663 175.537 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 . . . . . 0 N--CA 1.451 -0.383 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 50.6 m -138.3 79.97 29.43 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.449 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 71.9 Cg_endo -81.38 153.31 18.25 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.634 2.223 . . . . 0.0 113.102 -178.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . 0.508 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 99.2 p -159.09 150.38 20.27 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.206 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.471 ' HB2' HD23 ' B' ' 75' ' ' LEU . 45.0 t80 -108.83 128.01 54.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.597 -177.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.568 ' O ' ' HA ' ' B' ' 73' ' ' ASN . 0.1 OUTLIER -108.2 128.11 54.43 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 176.512 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -75.1 -25.41 58.51 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.297 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.402 ' HB3' ' OD1' ' B' ' 69' ' ' ASN . . . -60.79 -51.45 69.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.816 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.52 ' O ' HD13 ' B' ' 74' ' ' ILE . 11.0 mm-40 -103.62 -10.6 18.28 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . 0.568 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 1.8 p-10 59.95 45.34 12.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.499 1.143 . . . . 0.0 110.183 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.52 HD13 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.7 143.8 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 113.914 -1.494 . . . . 0.0 109.099 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.471 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.2 tm? -110.27 97.83 7.21 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.1 OUTLIER -87.42 143.69 27.11 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.037 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 45.3 mm -95.84 -56.08 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.417 -171.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -160.46 24.0 0.15 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -174.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.1 -22.94 5.58 Favored Glycine 0 C--N 1.322 -0.246 0 C-N-CA 120.122 -1.037 . . . . 0.0 112.774 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -79.48 -28.61 41.48 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.451 HD21 ' CB ' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -162.45 153.54 17.63 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.325 175.031 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 63.5 p -124.3 150.61 45.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.571 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -106.93 100.14 30.15 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.809 0.338 . . . . 0.0 110.328 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.519 ' HA ' HD12 ' B' ' 74' ' ' ILE . 25.9 Cg_exo -65.91 131.5 27.44 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.686 2.257 . . . . 0.0 112.005 177.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 87.6 mt -101.72 151.37 37.89 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.261 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.35 143.24 31.15 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.647 2.231 . . . . 0.0 112.206 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -3.38 49.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.5 -178.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -82.44 -9.62 59.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 59.9 mt -118.88 136.49 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.429 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.7 p -87.55 115.11 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 48.1 t -123.06 136.18 60.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.095 0.474 . . . . 0.0 111.248 -174.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.747 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.48 164.54 29.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.965 178.396 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.16 -23.83 65.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.652 -176.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.67 -12.03 56.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.769 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.747 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 14.4 t0 -104.06 -24.64 13.19 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.787 0.803 . . . . 0.0 109.244 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.36 117.69 24.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.219 -179.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.6 mmmt -112.09 108.0 17.12 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.985 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.486 HG22 HG23 ' A' ' 10' ' ' VAL . 47.2 mt -111.63 118.26 57.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -132.45 121.83 24.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.269 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.516 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 38.4 t-80 -107.02 112.09 24.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.958 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.597 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.9 mp -85.18 108.35 16.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -76.12 -24.9 54.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.119 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.5 -46.5 89.73 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.597 ' H ' HG22 ' B' ' 101' ' ' ILE . 14.6 mt-10 -92.12 -2.2 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.28 0.562 . . . . 0.0 110.096 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 47.6 mtp180 54.23 38.91 30.21 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.287 -177.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.471 HG23 ' HB3' ' B' ' 53' ' ' GLU . 32.8 m -123.34 131.95 53.83 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.82 -172.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.73 114.89 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.454 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.616 ' CE2' HD11 ' B' ' 51' ' ' LEU . 48.6 m-85 -93.67 120.87 34.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.05 177.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.544 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.4 mm -110.88 123.85 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.974 177.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.443 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 84.7 m-85 -122.69 129.12 51.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 63.8 mt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.738 -0.649 . . . . 0.0 109.618 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 27.2 p . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 121.343 0.592 . . . . 0.0 112.316 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.2 m -128.75 142.54 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.549 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.413 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -86.11 137.81 32.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 -177.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 mm -109.04 118.66 50.84 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.71 123.89 10.19 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.122 1.881 . . . . 0.0 111.849 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.5 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -96.14 127.92 47.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.773 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.514 HG12 HG13 ' A' ' 13' ' ' VAL . 58.6 t -92.12 128.21 43.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.71 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.436 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 39.5 mt-10 -97.49 109.11 21.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.328 0.585 . . . . 0.0 110.322 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.5 m -131.76 176.14 9.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.553 -177.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -101.2 -9.73 21.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.652 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -164.3 156.38 16.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.926 176.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.489 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -83.78 153.7 64.37 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.12 177.336 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -51.89 167.07 0.5 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.38 2.72 . . . . 0.0 113.318 173.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -72.3 130.54 41.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.99 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.6 29.91 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -173.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.28 153.05 18.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.071 0.462 . . . . 0.0 110.762 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -110.25 97.75 7.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.872 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.559 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 53.1 ttp85 . . . . . 0 C--N 1.324 -0.505 0 CA-C-O 121.071 0.462 . . . . 0.0 111.683 -176.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 . . . . . 0 N--CA 1.444 -0.73 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 90.4 m-85 -86.89 152.66 22.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.478 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -120.53 110.58 16.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.009 176.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 57.3 t -92.96 124.21 45.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.397 -178.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -121.57 137.92 54.53 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.107 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.526 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -120.43 139.83 52.26 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 -175.748 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.517 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.2 135.72 21.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.678 0.275 . . . . 0.0 110.295 -176.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.517 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -97.66 135.48 39.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 -178.128 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -118.26 147.53 43.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.458 177.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -133.72 119.8 19.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.065 0.459 . . . . 0.0 110.494 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.85 26.97 52.19 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.109 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.79 171.25 8.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.91 -13.98 60.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.133 0.492 . . . . 0.0 110.98 179.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.572 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -133.09 146.33 51.55 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 176.537 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.52 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 3.0 mppt? -100.95 -22.26 14.84 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.23 0.538 . . . . 0.0 109.726 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.562 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.94 135.42 36.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.225 -178.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -120.46 129.16 53.75 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -123.16 131.65 72.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.63 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -115.14 117.13 29.67 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.2 102.9 13.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.493 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.9 pt-20 -109.05 153.32 23.81 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.896 0.379 . . . . 0.0 110.168 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.62 113.85 26.07 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.91 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.404 ' NZ ' ' HB2' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.02 93.23 3.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.368 0.604 . . . . 0.0 110.562 178.066 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.757 179.559 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.0 t -131.96 78.17 70.22 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.536 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 81.6 Cg_endo -81.1 151.39 18.2 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.766 2.31 . . . . 0.0 113.621 -178.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 15.2 m -156.08 150.53 25.76 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.035 176.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.479 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 40.1 t80 -108.02 124.35 50.04 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.714 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.551 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.8 p-10 -103.3 112.36 25.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.109 0.481 . . . . 0.0 110.55 176.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.61 -33.01 73.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.575 -177.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.64 -48.92 68.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.623 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.56 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.4 mt-10 -110.54 5.93 21.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.411 -176.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 48.51 43.16 19.82 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.397 1.06 . . . . 0.0 111.587 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.56 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.2 mt -118.15 143.32 29.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.555 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.426 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -109.32 101.81 10.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.536 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -88.6 142.81 27.39 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.826 -178.086 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 47.5 mm -96.05 -48.92 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.576 -177.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -165.71 -168.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.584 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.75 -4.94 59.7 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.007 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -86.5 -40.12 15.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.454 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -161.6 154.02 20.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.602 0.715 . . . . 0.0 112.675 -179.762 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.9 p -123.58 148.25 46.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.415 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.6 mm -105.23 105.21 51.06 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 120.621 0.248 . . . . 0.0 110.536 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.477 ' HA ' HG12 ' B' ' 74' ' ' ILE . 59.1 Cg_endo -74.85 131.58 14.64 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.138 1.892 . . . . 0.0 111.77 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 65.9 mt -99.79 154.08 37.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.031 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.43 139.91 46.57 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.335 2.023 . . . . 0.0 112.061 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.403 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 9.7 mpt_? -77.59 -6.85 55.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -84.76 -12.43 53.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.302 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.6 mt -113.96 133.83 58.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.986 -176.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.5 127.78 39.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.481 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . 0.479 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -137.35 138.91 44.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.259 0.552 . . . . 0.0 111.524 -174.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.558 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.33 166.38 24.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.044 178.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.09 -22.57 64.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.147 0.499 . . . . 0.0 111.572 -177.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.81 -9.75 55.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.114 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.558 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 31.0 t70 -107.08 -23.76 12.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.755 0.788 . . . . 0.0 109.688 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.407 HG22 HG13 ' B' ' 98' ' ' ILE . 76.9 mt -74.74 116.69 17.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.443 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.4 mmmm -111.34 105.36 13.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.894 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.5 HG22 HG23 ' A' ' 10' ' ' VAL . 56.3 mt -110.17 120.55 61.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.994 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.23 119.2 21.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.436 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.4 t-80 -97.14 108.03 20.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.675 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.555 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 46.8 mt -86.7 98.01 6.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 172.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -72.99 -20.59 60.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -58.15 -49.09 78.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.472 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.474 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.4 mm-40 -99.88 1.14 42.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.538 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 55.02 36.13 26.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.269 -175.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.493 HG23 ' HB3' ' B' ' 53' ' ' GLU . 22.7 m -116.73 126.4 53.1 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.35 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 54.3 tp -101.28 121.72 42.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.662 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.63 ' CE2' HD11 ' B' ' 51' ' ' LEU . 21.2 m-85 -101.97 128.29 48.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.384 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.6 mm -116.3 122.0 68.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.66 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.49 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 86.0 m-85 -122.44 126.35 47.74 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.572 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--N 1.319 -0.752 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.715 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 28.5 p . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.4 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.3 m -124.22 140.73 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.068 0.461 . . . . 0.0 110.642 -178.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 135.1 35.03 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.157 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.4 mm -112.07 114.18 51.47 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -71.5 135.81 27.19 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 121.869 1.712 . . . . 0.0 111.08 175.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.496 HG23 HG22 ' B' ' 98' ' ' ILE . 1.4 p -100.41 128.59 52.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.748 -177.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.506 HG12 HG13 ' A' ' 13' ' ' VAL . 47.6 t -87.26 112.68 23.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.766 179.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.7 mt-10 -92.13 106.76 18.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.444 0.64 . . . . 0.0 110.223 179.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.506 HG13 HG12 ' A' ' 11' ' ' VAL . 2.2 m -129.21 -172.57 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.084 -175.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -96.87 -30.22 13.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.143 0.497 . . . . 0.0 109.661 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -149.66 166.05 30.51 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.233 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.8 mm? -80.05 141.47 54.5 Favored Pre-proline 0 C--N 1.316 -0.874 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.198 173.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.71 166.47 0.23 Allowed 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 123.485 2.79 . . . . 0.0 113.029 172.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -68.56 132.34 46.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.578 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.1 -2.17 29.91 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.638 -174.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -102.46 175.18 5.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.996 0.427 . . . . 0.0 111.142 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.59 112.33 12.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.707 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.494 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.5 ttp85 . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 178.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 . . . . . 0 N--CA 1.443 -0.796 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.453 ' HB2' HD21 ' B' ' 81' ' ' LEU . 96.1 m-85 -90.5 154.92 19.27 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.372 -178.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -120.0 108.9 14.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.068 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 92.1 t -91.11 129.36 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.008 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -127.07 142.75 51.45 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 176.791 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.559 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.3 ttt -123.97 141.21 52.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.637 -175.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.9 tmtt? -140.92 133.47 28.57 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.562 -176.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.46 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 9.2 mpt_? -99.34 138.73 36.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.995 0.426 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.404 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 53.8 m-85 -118.77 167.32 11.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.448 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.31 105.23 4.02 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.013 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.84 46.96 6.9 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.891 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.98 172.19 12.96 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 -25.27 64.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.554 0.692 . . . . 0.0 110.492 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.571 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -131.8 141.95 49.6 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.684 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.501 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.05 -21.42 15.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.266 0.555 . . . . 0.0 109.679 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.608 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.66 135.29 33.09 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.781 -178.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -124.51 133.6 53.28 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.608 HD11 HD12 ' B' ' 48' ' ' LEU . 2.4 mp -125.45 132.37 71.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.474 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.4 mm? -113.55 121.99 45.89 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.3 103.13 11.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 177.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.42 ' HB3' HG23 ' B' ' 106' ' ' THR . 14.0 pt-20 -114.99 153.41 30.67 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.106 0.479 . . . . 0.0 110.305 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -95.94 110.2 22.45 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.423 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -130.04 94.11 3.64 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.868 0.842 . . . . 0.0 110.536 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.084 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.515 179.437 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -136.92 79.64 38.34 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-O 121.096 0.474 . . . . 0.0 109.782 175.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -80.03 158.38 23.83 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.982 2.455 . . . . 0.0 113.486 -178.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 90.8 p -158.56 147.89 19.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.074 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.441 ' HB2' HD23 ' B' ' 75' ' ' LEU . 53.8 t80 -106.95 117.97 35.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.196 0.522 . . . . 0.0 110.847 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.486 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.5 p-10 -100.02 110.18 22.5 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.526 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -60.52 -33.58 72.85 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.66 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -51.79 -44.14 63.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.719 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.446 ' O ' HG13 ' B' ' 74' ' ' ILE . 4.1 mm-40 -111.56 4.0 18.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.46 44.9 17.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.422 -176.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.446 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.6 mt -121.74 135.05 63.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.163 -178.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.441 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -100.84 100.85 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.0 OUTLIER -84.83 144.63 28.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -177.757 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.8 mm -98.41 -59.57 3.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.299 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -144.88 -178.04 5.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.419 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.98 3.61 27.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.749 176.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -90.21 -40.56 12.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.505 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.4 pp -160.22 153.29 21.68 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.624 -0.717 . . . . 0.0 112.224 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 23.9 p -121.07 147.56 45.36 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.65 174.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.0 mm -102.71 103.99 36.02 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.852 0.358 . . . . 0.0 110.344 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.432 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.3 Cg_endo -81.88 130.38 6.62 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.281 1.988 . . . . 0.0 112.599 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -96.86 147.2 32.57 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.955 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.465 ' HG2' HD12 ' B' ' 89' ' ' ILE . 31.2 Cg_endo -65.36 140.65 64.77 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.199 1.932 . . . . 0.0 111.343 175.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.4 ' NH1' ' HA ' ' B' ' 86' ' ' PRO . 0.1 OUTLIER -73.14 -5.74 41.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.429 -175.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -81.5 -11.57 59.15 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.311 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.465 HD12 ' HG2' ' B' ' 86' ' ' PRO . 58.8 mt -114.84 136.64 50.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.902 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.1 p -84.51 113.41 23.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.215 0.531 . . . . 0.0 109.971 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 62.1 t -120.49 130.72 74.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-O 121.122 0.487 . . . . 0.0 111.128 -175.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.541 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.43 164.43 30.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.912 177.962 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.4 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.22 -18.01 63.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.871 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.4 -14.82 48.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.831 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.541 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 20.4 t70 -108.67 -23.98 11.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.837 -175.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.442 HG22 HG13 ' B' ' 98' ' ' ILE . 80.5 mt -73.45 115.33 14.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.18 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -110.09 98.82 8.01 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.575 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.496 HG22 HG23 ' A' ' 10' ' ' VAL . 39.2 mt -99.84 116.72 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.005 0.431 . . . . 0.0 110.766 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -130.66 121.34 25.38 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.095 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.453 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 75.6 t60 -109.54 125.29 52.35 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.047 0.451 . . . . 0.0 110.882 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.54 HG22 ' H ' ' B' ' 104' ' ' GLU . 85.4 mt -104.12 113.02 39.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.973 177.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.51 -23.38 61.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.709 0.29 . . . . 0.0 110.573 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.54 ' H ' HG22 ' B' ' 101' ' ' ILE . 42.7 mt-10 -95.23 0.67 54.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.135 0.493 . . . . 0.0 109.985 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 51.71 37.29 19.79 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.207 -173.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.42 HG23 ' HB3' ' B' ' 53' ' ' GLU . 62.4 m -121.52 133.98 55.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.535 -173.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.33 118.16 36.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.964 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.515 ' HB3' ' CE1' ' B' ' 110' ' ' TYR . 29.8 m-85 -98.12 119.05 36.09 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.9 179.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.492 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.3 mm -108.99 123.0 64.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.843 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 67.7 m-85 -122.53 126.64 48.21 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.571 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.776 -0.631 . . . . 0.0 109.775 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 13.4 p . . . . . 0 N--CA 1.454 -0.259 0 CA-C-O 120.809 0.338 . . . . 0.0 110.589 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.3 m -114.79 140.86 33.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.203 -177.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.417 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.4 OUTLIER -86.11 139.11 31.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.098 -179.865 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.547 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.0 mm -111.36 117.2 49.83 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.362 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -71.24 129.68 16.4 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.321 2.014 . . . . 0.0 112.428 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.07 137.07 21.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.406 HG12 HG13 ' A' ' 13' ' ' VAL . 67.6 t -101.15 112.95 35.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.56 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.0 mt-10 -94.98 107.88 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.418 0.628 . . . . 0.0 110.754 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.406 HG13 HG12 ' A' ' 11' ' ' VAL . 2.7 m -127.84 -173.27 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.631 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.47 -33.57 36.57 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -175.46 175.78 2.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.741 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.453 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.9 mm? -78.17 140.66 61.6 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-O 120.772 0.32 . . . . 0.0 110.844 -177.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.97 173.65 9.95 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.81 2.34 . . . . 0.0 111.738 174.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -56.82 139.4 51.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.014 0.435 . . . . 0.0 110.952 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.04 -22.48 23.14 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.647 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.422 ' HB2' ' HB3' ' A' ' 16' ' ' LEU . 66.7 m-85 -93.7 166.55 12.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.441 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -124.9 99.49 6.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.386 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.521 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 57.9 ttp85 . . . . . 0 C--N 1.321 -0.66 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.681 -178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.411 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 35.0 tt0 . . . . . 0 N--CA 1.45 -0.431 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.481 ' HB2' HD21 ' B' ' 81' ' ' LEU . 68.0 m-85 -87.19 153.88 21.16 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.417 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -132.87 116.59 16.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.558 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.7 p -102.27 132.3 48.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.01 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.61 151.35 44.94 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.701 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.0 OUTLIER -128.55 137.46 51.75 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -177.323 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.418 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 2.5 tmtp? -143.68 132.37 22.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.611 0.244 . . . . 0.0 110.413 -174.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.418 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.3 OUTLIER -95.65 141.4 29.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.335 -177.018 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -121.13 147.12 46.01 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -119.43 118.54 31.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.941 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.23 51.77 46.81 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.562 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.9 171.7 13.58 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.57 -16.95 62.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.251 0.548 . . . . 0.0 110.74 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.614 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -133.53 144.18 49.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.916 176.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.512 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.7 mppt? -98.87 -23.53 15.32 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -178.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.701 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -137.63 134.94 36.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.222 -179.125 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -120.18 117.89 29.07 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -111.91 130.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.558 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.1 mm? -112.62 112.85 24.68 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.375 -176.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.16 103.38 14.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.527 ' HB3' HG23 ' B' ' 106' ' ' THR . 10.3 pt-20 -113.28 150.31 32.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.026 0.441 . . . . 0.0 110.68 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -94.93 113.7 25.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.021 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 ptmm? -137.26 93.03 2.77 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.492 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . 0.411 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.577 175.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 120.694 0.283 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 p -133.45 78.74 62.14 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.459 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 86.3 Cg_endo -83.81 152.93 13.12 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.679 2.253 . . . . 0.0 112.158 179.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . 0.491 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.9 m -156.03 141.63 17.8 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.184 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.433 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 51.0 t80 -99.52 129.41 45.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.326 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.577 HD21 ' HB2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -108.28 131.09 55.07 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.562 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -79.02 -24.28 43.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.332 -178.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.417 ' HB3' ' OD1' ' B' ' 69' ' ' ASN . . . -62.96 -51.71 65.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.476 . . . . 0.0 110.988 -176.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.577 ' HB2' HD21 ' B' ' 69' ' ' ASN . 3.6 mt-10 -104.86 -2.34 24.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.284 178.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 58.94 39.62 23.47 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.171 0.986 . . . . 0.0 110.229 174.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.577 HG13 ' O ' ' B' ' 72' ' ' GLU . 86.2 mt -118.67 136.3 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 114.447 -1.252 . . . . 0.0 111.131 -177.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.405 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.9 tm? -100.1 100.52 11.39 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.491 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -87.68 141.18 28.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.587 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.8 mm -90.94 -49.64 13.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.89 -175.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.2 m-20 -157.92 -170.54 3.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.39 21.19 5.35 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.398 178.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -107.07 -47.17 3.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.31 0.576 . . . . 0.0 110.038 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -151.1 153.08 34.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.296 -178.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 24.1 p -126.97 145.51 50.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.951 178.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.5 102.75 39.43 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-O 120.817 0.341 . . . . 0.0 110.66 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.464 ' HA ' HG12 ' B' ' 74' ' ' ILE . 74.1 Cg_endo -78.74 134.59 12.21 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.157 1.905 . . . . 0.0 112.3 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -98.49 153.27 38.06 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.464 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.436 ' HG2' HD12 ' B' ' 89' ' ' ILE . 37.1 Cg_endo -66.59 140.61 57.48 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.488 2.126 . . . . 0.0 111.322 175.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.61 -8.66 57.33 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.211 -176.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.75 -13.35 59.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.282 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.436 HD12 ' HG2' ' B' ' 86' ' ' PRO . 57.7 mt -114.15 135.15 54.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.895 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 90.7 t -86.79 114.47 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . 0.433 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.0 p -123.44 134.85 65.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.329 0.585 . . . . 0.0 111.325 -175.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.501 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.06 166.43 24.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.546 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.6 -12.26 60.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.749 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.63 -9.87 48.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.37 0.605 . . . . 0.0 110.637 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.501 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.2 t70 -111.39 -24.1 10.39 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.766 -178.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.406 HG22 HG13 ' B' ' 98' ' ' ILE . 82.4 mt -73.73 120.1 22.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.284 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.452 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -113.82 103.05 10.81 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.69 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.547 HD12 ' HB ' ' A' ' 8' ' ' ILE . 37.5 mt -105.75 120.98 57.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.98 0.419 . . . . 0.0 111.439 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -132.85 121.25 22.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.472 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.56 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 15.5 t-80 -105.24 117.9 35.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.42 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.702 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.3 mp -91.49 125.34 44.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . 0.445 ' HD3' ' OE2' ' A' ' 12' ' ' GLU . 12.1 mmm180 -76.22 -42.61 45.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.465 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . 0.417 ' HE3' ' HB2' ' B' ' 103' ' ' LYS . 36.0 ttmt -59.53 -47.82 84.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.681 -175.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.702 ' H ' HG22 ' B' ' 101' ' ' ILE . 16.0 mm-40 -87.47 -3.94 59.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.859 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 53.54 38.97 29.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.858 -175.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.527 HG23 ' HB3' ' B' ' 53' ' ' GLU . 59.6 m -125.92 137.87 53.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.93 0.395 . . . . 0.0 111.097 -172.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . 0.487 HD13 ' HB2' ' B' ' 100' ' ' HIS . 27.5 tp -109.23 119.72 40.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.181 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.564 ' CE1' HD13 ' B' ' 101' ' ' ILE . 47.4 m-85 -102.11 129.16 48.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.2 mm -115.39 118.43 58.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.808 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.7 m-85 -117.18 125.7 51.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.614 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.2 mt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.655 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.444 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 33.1 p . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 110.064 -0.346 . . . . 0.0 110.064 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -117.45 143.01 29.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.752 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.442 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -87.82 137.47 32.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.308 -178.074 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.451 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.3 mm -109.78 114.94 56.12 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.31 128.69 14.01 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.292 1.995 . . . . 0.0 112.269 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.52 132.67 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.111 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.467 HG12 HG13 ' A' ' 13' ' ' VAL . 79.4 t -94.72 114.55 31.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 174.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.487 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 23.0 mt-10 -91.1 111.2 22.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.549 0.69 . . . . 0.0 110.811 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.467 HG13 HG12 ' A' ' 11' ' ' VAL . 2.6 m -127.55 179.26 3.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.513 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -89.84 -28.05 19.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.147 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -169.64 164.14 10.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.977 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.516 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -78.92 143.72 62.47 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 120.692 0.282 . . . . 0.0 110.331 -178.351 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -71.35 175.04 9.92 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.917 2.412 . . . . 0.0 112.44 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.94 138.57 11.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.707 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.1 -5.09 61.09 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.166 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -106.49 149.23 27.3 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.172 0.51 . . . . 0.0 111.653 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -110.68 98.09 7.34 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.245 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.516 ' HD2' HD22 ' A' ' 16' ' ' LEU . 10.0 ttt180 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.181 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 . . . . . 0 N--CA 1.442 -0.848 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.461 ' HB2' HD21 ' B' ' 81' ' ' LEU . 81.3 m-85 -87.06 137.77 32.06 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.498 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.522 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 36.1 tt0 -110.19 113.7 26.59 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.04 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 96.8 t -93.98 124.06 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.917 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -118.58 131.76 56.2 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.22 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.652 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -118.91 135.78 54.4 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -176.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.492 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 5.3 tmtm? -142.57 131.65 23.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.869 0.366 . . . . 0.0 110.775 -173.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.492 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -90.5 132.04 35.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.927 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -116.69 149.01 40.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.904 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -132.29 122.62 25.42 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.547 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.03 23.85 58.65 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.307 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -113.28 170.8 7.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.79 -11.01 60.53 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 177.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.59 142.05 43.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.568 177.102 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.493 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.29 -19.69 18.38 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.148 0.499 . . . . 0.0 109.752 -175.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.652 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -135.83 132.76 37.06 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.65 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -115.93 122.02 44.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.202 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.607 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -121.41 128.95 75.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.555 HD11 ' CD2' ' B' ' 108' ' ' TYR . 3.7 mm? -114.83 120.61 40.6 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -122.12 103.56 13.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -113.06 153.49 28.05 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.147 0.499 . . . . 0.0 110.312 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.51 111.33 23.7 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.343 -176.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' B' ' 55' ' ' LYS . 7.6 ptmm? -134.7 92.19 2.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.182 0.515 . . . . 0.0 110.837 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.666 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.276 176.046 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.14 0.495 . . . . 0.0 110.539 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.4 t -134.66 79.63 52.58 Favored Pre-proline 0 C--N 1.317 -0.812 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.039 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.08 158.18 13.36 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.813 2.342 . . . . 0.0 112.019 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.3 m -158.1 144.57 17.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.038 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.437 ' HB2' HD23 ' B' ' 75' ' ' LEU . 72.2 t80 -104.34 128.95 52.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.358 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.476 ' OD1' ' HB3' ' B' ' 71' ' ' ALA . 0.1 OUTLIER -109.69 125.33 52.52 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.632 178.311 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -75.72 -24.82 56.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.444 -175.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . 0.476 ' HB3' ' OD1' ' B' ' 69' ' ' ASN . . . -62.28 -42.0 98.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.492 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.524 ' O ' HD13 ' B' ' 74' ' ' ILE . 12.6 mt-10 -112.96 -7.81 13.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.291 178.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 60.52 42.35 14.36 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 124.644 1.215 . . . . 0.0 110.38 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.524 HD13 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.67 138.51 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.008 178.266 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.8 tm? -106.33 99.86 9.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.12 144.66 27.4 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.7 mm -105.25 -49.37 9.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.076 0.465 . . . . 0.0 111.193 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.65 174.31 11.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -175.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.82 4.75 28.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.437 -0.887 . . . . 0.0 111.255 174.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 30.2 mttp -101.43 -34.57 9.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.906 -0.647 . . . . 0.0 110.424 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.5 OUTLIER -157.62 152.51 25.48 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.56 0.695 . . . . 0.0 111.989 -177.173 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 28.4 p -133.3 143.61 49.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.805 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.5 mm -101.76 106.48 47.1 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.475 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.497 ' HA ' HD12 ' B' ' 74' ' ' ILE . 73.4 Cg_endo -82.1 135.12 8.42 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.135 1.89 . . . . 0.0 112.343 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.59 149.05 35.54 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.55 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.425 ' HG2' HD12 ' B' ' 89' ' ' ILE . 32.5 Cg_endo -68.34 142.47 54.88 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.148 1.899 . . . . 0.0 111.337 175.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.462 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 8.9 mpt_? -78.74 -0.06 28.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.682 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -81.78 -15.61 53.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.043 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.425 HD12 ' HG2' ' B' ' 86' ' ' PRO . 51.5 mt -109.98 134.12 53.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.979 -176.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.96 114.38 25.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.64 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 51.4 t -120.6 135.5 60.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.303 0.573 . . . . 0.0 111.246 -173.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.527 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.07 161.15 38.54 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.708 177.483 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.72 64.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.799 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.62 -16.03 49.91 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.061 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.527 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.1 t0 -104.05 -22.21 13.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.603 0.715 . . . . 0.0 109.706 -177.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.2 mt -73.99 119.28 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.276 178.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -113.14 108.86 17.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.856 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.451 HD12 ' HB ' ' A' ' 8' ' ' ILE . 55.5 mt -113.33 119.5 60.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.885 0.374 . . . . 0.0 111.296 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -128.56 117.7 21.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -178.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.487 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 32.3 t-80 -100.08 121.18 41.0 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.687 HG22 ' H ' ' B' ' 104' ' ' GLU . 70.5 mt -102.84 104.84 17.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 173.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -79.05 -18.05 54.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.186 -176.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.93 -44.33 85.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.424 0.631 . . . . 0.0 109.995 174.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.687 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.8 tp10 -94.24 -4.42 48.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.083 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 57.1 35.1 25.88 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.738 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.416 HG23 ' HB3' ' B' ' 53' ' ' GLU . 61.4 m -126.65 137.3 53.28 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.851 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.4 tp -106.52 125.31 50.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.277 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.603 ' CE1' HD12 ' B' ' 101' ' ' ILE . 21.6 m-85 -105.82 126.14 51.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.835 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.607 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.0 mm -116.48 124.92 73.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.027 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.415 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.2 m-85 -126.63 126.79 44.17 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.527 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.5 mt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.006 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 p . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.3 m -112.39 142.81 23.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.91 0.386 . . . . 0.0 110.875 -176.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.479 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -86.82 137.66 32.23 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.24 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.0 mm -109.11 121.79 41.74 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.874 -0.331 . . . . 0.0 110.272 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.2 127.83 14.78 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.368 2.045 . . . . 0.0 112.226 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.458 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -101.94 130.94 50.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.449 HG12 HG13 ' A' ' 13' ' ' VAL . 50.7 t -97.35 121.65 48.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.923 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.531 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 44.4 mt-10 -95.49 106.28 18.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.186 0.517 . . . . 0.0 110.799 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.535 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 3.6 m -128.79 -175.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.979 -177.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -99.46 -23.07 15.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.248 0.547 . . . . 0.0 109.879 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.73 156.3 36.11 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.87 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.91 146.09 48.25 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -69.24 173.66 10.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.553 2.168 . . . . 0.0 112.15 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -52.02 140.09 21.22 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.966 -177.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.34 -20.32 42.9 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.057 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -89.79 147.37 23.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.07 0.462 . . . . 0.0 111.509 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -108.02 106.47 16.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.477 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 . . . . . 0 C--N 1.324 -0.514 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.501 177.619 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.411 ' N ' ' HB2' ' B' ' 56' ' ' ALA . 33.9 tt0 . . . . . 0 N--CA 1.445 -0.716 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.509 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 84.7 m-85 -81.87 148.36 28.84 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -124.35 115.32 20.81 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.595 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.6 p -102.41 134.86 41.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.94 -173.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.426 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -126.19 147.23 49.69 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.182 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.618 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -121.85 135.88 54.91 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.618 -178.464 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.506 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 4.9 tmtm? -137.05 131.94 33.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.336 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.423 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.6 OUTLIER -95.23 137.23 34.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.857 0.36 . . . . 0.0 111.101 -179.504 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.506 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 39.5 m-85 -119.62 160.5 22.37 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.733 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -143.08 121.55 12.41 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 76.8 29.58 57.24 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.447 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.03 171.73 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.44 -12.77 55.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.172 0.511 . . . . 0.0 110.485 177.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.539 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -137.75 146.55 43.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.862 177.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.502 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.58 -21.52 15.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.247 0.546 . . . . 0.0 109.609 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.618 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.03 136.99 38.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.352 -178.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -124.38 121.6 35.38 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.599 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -113.73 129.86 68.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.595 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 4.4 mm? -112.36 115.09 28.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.136 -177.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.0 103.56 14.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -109.48 153.31 24.24 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.475 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . 0.46 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -94.74 114.44 26.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.994 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.442 ' N ' HD22 ' B' ' 54' ' ' ASN . 16.4 ptmt -137.94 92.18 2.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.282 0.563 . . . . 0.0 110.89 176.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . 0.411 ' HB2' ' N ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.321 -0.631 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 174.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 14.7 m -129.25 78.35 76.11 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 0.0 109.781 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 61.0 Cg_endo -81.45 145.37 14.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.317 2.011 . . . . 0.0 112.136 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . 0.562 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.5 m -155.38 144.11 20.56 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.246 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.404 ' HE2' ' CD2' ' B' ' 70' ' ' PHE . 65.2 t80 -105.3 120.37 41.4 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.52 -177.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.505 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.1 p-10 -99.74 114.95 28.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.424 175.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.404 ' CD2' ' HE2' ' B' ' 68' ' ' TYR . 85.1 m-85 -63.88 -32.12 73.53 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.42 -176.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.27 -41.81 69.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.973 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.534 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.98 1.79 15.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.623 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.73 45.55 21.76 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.363 1.039 . . . . 0.0 111.32 -175.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.534 HG13 ' O ' ' B' ' 72' ' ' GLU . 72.3 mt -123.26 137.62 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.135 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -105.8 107.05 17.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.564 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 10.8 p90 -95.36 144.82 25.59 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.165 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 49.3 mm -91.8 -40.77 12.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.721 -175.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.9 m-20 -161.16 -175.96 5.17 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.48 7.31 40.17 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.586 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.46 -37.99 11.15 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.074 0.464 . . . . 0.0 110.21 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.485 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -159.26 153.01 22.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.944 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 10.1 p -128.16 141.62 51.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.642 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 45.5 mm -104.69 105.62 51.34 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.852 0.358 . . . . 0.0 110.673 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.442 ' HA ' HG12 ' B' ' 74' ' ' ILE . 73.6 Cg_endo -80.9 134.51 9.55 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.188 1.925 . . . . 0.0 112.632 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.48 143.84 27.17 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.76 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -67.27 142.2 59.63 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.133 1.889 . . . . 0.0 111.306 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -71.26 -5.01 28.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.125 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -75.31 -17.07 60.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.45 0.643 . . . . 0.0 109.709 178.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 53.5 mt -113.7 137.71 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.764 -176.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 60.6 t -90.64 113.9 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 2.3 p -124.53 134.57 66.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.155 0.502 . . . . 0.0 111.185 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 167.32 22.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.302 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.58 -23.68 64.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 111.556 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.89 -9.8 58.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.033 -177.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -113.89 -21.1 10.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.021 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 79.5 mt -75.33 117.97 20.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.354 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.418 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 10.8 mmmm -113.07 107.83 16.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.68 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.458 HG22 HG23 ' A' ' 10' ' ' VAL . 46.7 mt -110.38 120.77 61.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 0.0 111.518 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -133.23 119.52 19.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.614 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 16.9 t-80 -101.82 113.89 27.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.628 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.649 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.4 mt -89.93 108.43 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -69.2 -40.65 77.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.716 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -58.6 -47.44 84.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.108 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.649 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.3 tp10 -87.06 -3.19 59.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.191 -176.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 59.3 27.85 17.02 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.726 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 35.0 m -124.43 134.42 53.08 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.116 0.484 . . . . 0.0 111.231 -171.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' B' ' 100' ' ' HIS . 37.5 tp -103.6 123.13 46.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.098 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.588 ' CE1' HD12 ' B' ' 101' ' ' ILE . 14.8 m-85 -103.83 124.43 48.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.894 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.599 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.9 mm -112.23 120.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.619 175.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.494 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.3 m-85 -118.63 125.87 50.7 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 71.7 mt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.642 -0.694 . . . . 0.0 109.986 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.454 -0.271 0 CA-C-O 120.901 0.381 . . . . 0.0 110.684 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.479 HG21 ' HB2' ' B' ' 93' ' ' ALA . 27.6 m -134.09 164.32 34.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.349 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.03 153.75 24.18 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.446 ' HB ' HD12 ' B' ' 98' ' ' ILE . 5.2 mm -118.74 128.24 26.08 Favored Pre-proline 0 C--N 1.307 -1.25 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.413 -174.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.98 135.07 24.63 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.452 2.102 . . . . 0.0 111.939 177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.493 HG23 HG22 ' B' ' 98' ' ' ILE . 2.6 p -113.64 130.81 67.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.173 0.511 . . . . 0.0 110.566 178.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.76 HG12 ' HA ' ' B' ' 99' ' ' PHE . 4.0 p -86.22 149.03 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.512 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.581 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 34.6 mt-10 -115.81 94.46 4.69 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.595 0.712 . . . . 0.0 110.225 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.429 HG13 HG22 ' A' ' 11' ' ' VAL . 10.2 m -114.16 179.72 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.492 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -95.62 -24.9 16.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.365 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -168.36 163.0 12.78 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.415 176.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.4 mt -83.48 154.02 65.57 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-O 121.066 0.46 . . . . 0.0 111.674 -175.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 165.93 31.13 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.894 2.396 . . . . 0.0 111.428 176.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.413 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -61.54 136.36 57.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.341 -179.142 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -4.75 29.99 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.817 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -111.13 139.01 46.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.376 0.608 . . . . 0.0 111.856 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -93.74 94.69 8.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.81 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.621 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 31.6 ttp85 . . . . . 0 C--N 1.322 -0.607 0 CA-C-O 121.27 0.557 . . . . 0.0 111.54 -175.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 . . . . . 0 N--CA 1.445 -0.717 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.504 ' HB2' HD21 ' B' ' 81' ' ' LEU . 85.8 m-85 -86.04 157.68 20.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.497 -177.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.425 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 36.8 tt0 -131.51 119.18 21.19 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 171.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.79 136.32 27.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.466 -175.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.447 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -130.88 146.41 52.3 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 176.652 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.613 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.6 OUTLIER -124.75 136.64 54.04 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -177.332 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.479 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.1 tmtp? -136.58 129.49 30.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.742 0.306 . . . . 0.0 110.185 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.474 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 6.7 mpt_? -97.11 134.3 40.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.023 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.479 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.0 m-85 -114.2 164.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.454 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -144.35 119.23 9.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.784 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.72 43.79 93.56 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.804 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -124.56 171.35 10.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -19.24 65.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.293 0.568 . . . . 0.0 110.688 178.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.504 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.04 136.36 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.228 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 3.0 mppt? -87.68 -25.1 23.66 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.09 0.472 . . . . 0.0 110.041 -173.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.613 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.17 138.9 35.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.642 -178.215 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -122.97 119.9 31.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.709 175.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.584 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.0 mp -113.64 128.06 70.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.4 mm? -110.68 117.46 33.53 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.082 -178.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -124.06 103.99 13.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.509 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.6 pt-20 -108.36 149.28 28.91 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.484 -178.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.62 113.0 24.53 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.768 -177.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -133.51 93.95 3.23 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.508 0.67 . . . . 0.0 110.74 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.807 -179.709 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.2 m -137.41 80.18 33.99 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-O 120.917 0.389 . . . . 0.0 110.096 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.95 150.02 23.17 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.587 2.192 . . . . 0.0 111.948 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 9.6 m -154.65 150.05 27.25 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.426 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.498 ' HB2' HD23 ' B' ' 75' ' ' LEU . 61.9 t80 -115.08 124.43 51.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.365 0.603 . . . . 0.0 111.19 -176.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.46 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.2 p-10 -105.03 113.43 27.02 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.389 174.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . 0.403 ' CD2' ' HE2' ' B' ' 68' ' ' TYR . 88.1 m-85 -63.9 -32.82 74.48 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.907 -176.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.73 70.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.727 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.511 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -109.9 2.98 20.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.208 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.83 44.7 18.31 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.477 1.11 . . . . 0.0 111.36 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.511 HG13 ' O ' ' B' ' 72' ' ' GLU . 61.6 mt -121.49 134.16 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.484 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.498 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -101.95 107.09 18.13 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 176.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.38 140.61 29.41 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 41.2 mm -91.63 -59.62 2.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.051 0.453 . . . . 0.0 110.655 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -149.68 -179.48 7.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.326 -178.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.12 6.44 7.1 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.244 177.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -94.43 -43.41 8.38 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.506 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.6 pp -157.82 153.72 26.89 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.708 -177.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 41.3 t -130.12 149.06 51.99 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.683 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.1 mm -112.6 105.77 55.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.897 0.38 . . . . 0.0 111.104 -174.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -79.04 136.86 13.3 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.352 2.034 . . . . 0.0 112.416 177.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.46 156.08 35.6 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.284 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.456 ' HG2' HD12 ' B' ' 89' ' ' ILE . 31.9 Cg_endo -64.92 141.06 69.29 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.31 2.007 . . . . 0.0 111.492 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.525 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 8.4 mpt_? -80.1 1.81 26.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.778 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.5 -20.28 28.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.286 0.565 . . . . 0.0 109.974 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.456 HD12 ' HG2' ' B' ' 86' ' ' PRO . 62.2 mt -103.99 134.61 44.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.601 -174.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.6 t -84.17 110.13 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.696 177.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 45.2 t -111.78 132.56 60.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.499 -175.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.604 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.78 161.15 38.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.78 178.757 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.479 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.29 -18.0 63.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.699 -176.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.65 -12.36 54.08 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.604 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 21.9 t70 -110.99 -24.04 10.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.097 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.407 HG22 HG13 ' B' ' 98' ' ' ILE . 84.6 mt -71.42 113.43 7.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.197 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.447 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.5 mmmt -109.54 105.7 15.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.93 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.493 HG22 HG23 ' A' ' 10' ' ' VAL . 57.0 mt -109.73 121.87 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.073 0.463 . . . . 0.0 111.69 -177.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.76 ' HA ' HG12 ' A' ' 11' ' ' VAL . 88.3 m-85 -129.07 118.41 22.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.627 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.581 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 19.9 t-80 -99.39 106.66 18.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.097 0.475 . . . . 0.0 109.859 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.61 HD12 ' CE1' ' B' ' 108' ' ' TYR . 70.4 mt -87.24 115.24 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.698 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 102' ' ' ARG . 33.2 mtp85 -77.25 -19.31 56.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.399 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -57.63 -48.56 79.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.767 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.51 ' H ' HG22 ' B' ' 101' ' ' ILE . 63.1 mm-40 -106.85 0.28 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.707 -179.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 54.07 40.54 31.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.83 -172.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.509 HG23 ' HB3' ' B' ' 53' ' ' GLU . 50.7 m -119.65 137.35 53.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.815 -174.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.75 119.6 39.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.424 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.621 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 24.5 m-85 -101.81 123.01 45.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.732 178.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.56 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.9 mm -113.19 119.44 60.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.947 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.447 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 88.8 m-85 -118.84 128.69 54.69 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.504 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.2 mt . . . . . 0 C--O 1.243 0.754 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.352 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.0 p . . . . . 0 N--CA 1.45 -0.462 0 CA-C-O 121.186 0.517 . . . . 0.0 111.592 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -128.53 144.19 38.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.669 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.76 137.33 33.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.904 0.383 . . . . 0.0 110.004 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.417 ' HB ' HD12 ' B' ' 98' ' ' ILE . 10.4 mm -108.05 120.31 47.29 Favored Pre-proline 0 C--N 1.316 -0.849 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.13 127.7 16.37 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.23 1.953 . . . . 0.0 112.178 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.488 HG23 HG22 ' B' ' 98' ' ' ILE . 2.2 p -102.46 127.12 56.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.535 HG12 HG13 ' A' ' 13' ' ' VAL . 47.8 t -95.02 125.73 47.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.056 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.462 ' OE1' ' HD2' ' B' ' 102' ' ' ARG . 44.3 mt-10 -90.55 107.04 18.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.215 0.531 . . . . 0.0 110.253 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.672 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 11.0 m -126.63 177.4 5.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.357 -179.221 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -98.64 -16.97 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.008 0.432 . . . . 0.0 110.03 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -170.52 159.1 6.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.574 178.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.456 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.5 mm? -76.83 150.72 81.77 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.08 172.83 13.14 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.272 1.981 . . . . 0.0 111.634 174.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.52 139.51 58.23 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.139 0.495 . . . . 0.0 111.004 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.83 -15.0 37.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.132 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -95.35 166.71 11.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.89 0.376 . . . . 0.0 111.427 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -123.41 96.25 4.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.46 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.456 ' HB2' HD23 ' A' ' 16' ' ' LEU . 22.5 ttp85 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.125 178.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.485 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 39.0 tt0 . . . . . 0 N--CA 1.446 -0.652 0 CA-C-O 121.435 0.636 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -83.82 157.2 22.13 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.014 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -133.12 119.59 20.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.009 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.6 t -96.09 133.52 37.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.888 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.467 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.02 120.58 27.79 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.582 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.2 ttt -105.09 145.93 29.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.497 0.189 . . . . 0.0 110.614 -174.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.445 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.48 132.89 18.59 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -176.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.445 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.59 136.41 36.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.101 0.477 . . . . 0.0 110.86 179.702 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -117.57 167.65 11.12 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.363 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -156.59 109.43 2.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.938 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.4 11.85 46.85 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.305 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -111.69 171.59 7.4 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.15 -24.77 63.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.354 0.597 . . . . 0.0 110.706 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.652 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.4 p90 -124.42 142.75 51.06 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.859 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.467 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.9 mppt? -102.04 -18.55 15.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.98 -175.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.624 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -140.23 132.93 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.823 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -119.67 120.32 36.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 177.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.624 HD11 HD12 ' B' ' 48' ' ' LEU . 2.0 mp -118.05 129.21 74.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.497 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.03 114.58 26.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.188 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.43 103.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -110.33 152.92 25.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.262 0.554 . . . . 0.0 111.118 -176.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . 0.433 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -94.6 113.35 25.15 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.053 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -137.94 91.48 2.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.171 0.51 . . . . 0.0 110.467 176.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . 0.485 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.016 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.7 m -137.09 79.23 38.39 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-O 121.164 0.507 . . . . 0.0 109.829 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -76.27 153.0 35.55 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.865 2.377 . . . . 0.0 112.668 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.9 m -153.91 147.33 24.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.138 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -103.92 120.73 41.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.304 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.545 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.8 p-10 -100.2 112.38 24.7 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.386 176.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -63.1 -33.21 74.95 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.595 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.13 77.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.875 -175.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.487 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -112.45 3.4 16.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.257 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . 0.485 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.2 p-10 47.05 45.77 15.85 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.38 1.072 . . . . 0.0 111.616 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.545 ' HB ' HD21 ' B' ' 69' ' ' ASN . 63.7 mt -121.4 139.29 48.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.065 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -102.22 102.54 12.96 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.0 140.88 29.42 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -177.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -94.75 -54.43 7.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.469 -177.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -149.64 178.79 8.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.49 6.6 15.87 Favored Glycine 0 CA--C 1.517 0.184 0 C-N-CA 120.659 -0.781 . . . . 0.0 111.939 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -96.21 -37.3 10.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.49 . . . . 0.0 110.066 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.427 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -158.01 151.92 24.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 112.094 178.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.0 p -128.78 148.72 50.88 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.67 177.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.418 HG21 HG12 ' B' ' 50' ' ' ILE . 49.5 mm -105.86 104.25 48.09 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.896 0.379 . . . . 0.0 110.391 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.494 ' HA ' HG12 ' B' ' 74' ' ' ILE . 61.4 Cg_endo -75.48 131.76 14.1 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.245 1.963 . . . . 0.0 112.211 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 54.0 mt -101.32 146.5 32.3 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.237 -175.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.437 ' HG2' HD12 ' B' ' 89' ' ' ILE . 33.0 Cg_endo -66.65 142.85 65.82 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.276 1.984 . . . . 0.0 111.4 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.485 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.2 mpt_? -78.24 1.01 22.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.533 -175.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -93.28 -1.4 56.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.579 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.437 HD12 ' HG2' ' B' ' 86' ' ' PRO . 60.0 mt -116.73 137.92 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 67.1 t -87.03 113.02 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 1.6 p -125.27 132.49 71.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.311 0.577 . . . . 0.0 111.393 -174.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.487 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -142.37 163.64 32.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.028 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.23 63.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.67 -13.4 51.59 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.487 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 31.3 t70 -111.28 -21.19 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.111 -175.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.41 HG22 HG21 ' A' ' 8' ' ' ILE . 82.0 mt -75.73 118.56 22.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.169 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.47 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.1 mmmt -111.98 107.72 16.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.114 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.488 HG22 HG23 ' A' ' 10' ' ' VAL . 53.4 mt -111.42 121.43 63.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.983 0.421 . . . . 0.0 111.364 -178.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -132.66 122.53 24.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.205 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.433 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 45.3 t60 -102.86 110.7 22.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.998 0.428 . . . . 0.0 110.752 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.761 HG22 ' H ' ' B' ' 104' ' ' GLU . 56.1 mt -91.16 114.18 28.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.195 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . 0.462 ' HD2' ' OE1' ' A' ' 12' ' ' GLU . 39.5 mtp85 -81.06 -26.09 36.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.126 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.4 tttp -58.55 -42.31 87.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.337 177.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.761 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.6 tp10 -105.29 1.7 28.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.306 0.574 . . . . 0.0 110.002 -177.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 55.47 31.47 17.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.903 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 37.2 m -123.49 139.95 53.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 121.015 0.436 . . . . 0.0 110.939 -173.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.53 121.32 44.05 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.799 178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.637 ' CE1' HD12 ' B' ' 101' ' ' ILE . 8.4 m-85 -100.42 126.36 46.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.245 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.57 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 39.0 mm -115.94 117.73 56.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.732 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.47 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 87.3 m-85 -119.01 123.04 43.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.652 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 68.1 mt . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.745 -0.645 . . . . 0.0 109.807 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 39.2 p . . . . . 0 N--CA 1.446 -0.667 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.466 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.0 m -120.66 140.1 45.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.013 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.435 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -86.54 139.45 30.84 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.768 -179.223 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.448 ' HB ' HD12 ' B' ' 98' ' ' ILE . 5.1 mm -112.13 119.6 43.67 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -70.54 128.73 15.71 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.236 1.957 . . . . 0.0 112.105 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG13 HG22 ' B' ' 98' ' ' ILE . 48.0 t -83.58 135.45 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.135 178.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.581 HG12 HG13 ' A' ' 13' ' ' VAL . 38.6 t -99.18 111.07 27.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.506 ' OE1' ' HD3' ' B' ' 102' ' ' ARG . 45.1 mt-10 -85.9 102.21 13.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 0.0 110.605 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.581 HG13 HG12 ' A' ' 11' ' ' VAL . 5.8 m -123.16 -176.46 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.072 -178.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -94.43 -29.96 14.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -162.61 162.93 27.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.534 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.458 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -81.72 143.45 50.61 Favored Pre-proline 0 N--CA 1.448 -0.539 0 CA-C-O 120.776 0.322 . . . . 0.0 110.817 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -51.62 171.0 0.16 Allowed 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 123.931 3.087 . . . . 0.0 113.469 174.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -65.59 141.13 58.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.494 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.48 -4.6 60.09 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.493 -0.861 . . . . 0.0 111.22 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.71 164.76 11.72 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.48 94.36 4.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.042 0.449 . . . . 0.0 111.563 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.458 ' HB2' HD23 ' A' ' 16' ' ' LEU . 13.4 ttp180 . . . . . 0 C--N 1.321 -0.65 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.8 m-85 -86.39 156.51 20.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.602 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.536 ' OE2' ' HE2' ' B' ' 37' ' ' LYS . 35.0 tt0 -129.24 118.64 22.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.506 -0.77 . . . . 0.0 108.983 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -94.29 133.88 33.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.412 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.536 ' HE2' ' OE2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -128.84 145.41 51.21 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.382 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -125.68 138.38 53.89 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.442 -178.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.598 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 6.6 tmtm? -142.13 135.12 28.74 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -173.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.443 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 7.7 mpt_? -99.07 133.33 43.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.813 0.339 . . . . 0.0 111.122 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.598 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 45.8 m-85 -118.44 150.79 38.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.619 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -134.39 120.94 20.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.642 177.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.36 26.49 51.54 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.578 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.22 171.81 8.03 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -20.53 65.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.335 0.588 . . . . 0.0 110.391 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.6 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -126.38 142.01 51.69 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.6 mppt? -101.81 -21.53 14.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.599 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.76 130.52 25.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.899 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -116.11 129.73 56.47 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.599 HD11 HD12 ' B' ' 48' ' ' LEU . 2.7 mp -122.06 130.64 74.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.542 HD11 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -116.47 123.59 47.86 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.277 -176.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.7 mp -125.61 103.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.545 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.1 pt-20 -108.38 153.6 23.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.949 0.404 . . . . 0.0 110.191 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.18 113.6 25.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.662 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -135.65 93.19 2.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.6 0.714 . . . . 0.0 110.318 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.48 -179.0 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 . . . . . 0 CA--C 1.516 -0.365 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.2 m -130.58 78.81 73.35 Favored Pre-proline 0 C--N 1.318 -0.769 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.208 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.458 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 94.8 Cg_endo -84.54 156.02 12.23 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.557 2.171 . . . . 0.0 112.492 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.8 p -162.11 139.67 8.56 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.112 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.446 ' HB2' HD23 ' B' ' 75' ' ' LEU . 60.7 t80 -104.34 128.05 52.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.436 -178.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.551 HD21 ' HB2' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -105.37 132.59 51.37 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -79.61 -25.74 41.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.499 -178.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.66 -51.11 66.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.143 0.496 . . . . 0.0 110.841 -175.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.551 ' HB2' HD21 ' B' ' 69' ' ' ASN . 2.4 mt-10 -104.68 -3.39 23.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.15 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 2.3 p-10 57.74 43.67 21.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.088 0.947 . . . . 0.0 110.909 173.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' B' ' 72' ' ' GLU . 62.4 mt -119.84 134.28 63.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.14 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.446 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.6 tm? -105.48 103.3 12.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.971 178.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -91.43 146.56 23.7 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.54 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 40.3 mm -99.01 -51.86 9.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.481 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.445 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.9 m-20 -155.67 179.48 9.15 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.31 33.92 1.12 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.381 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . 0.445 ' H ' ' C ' ' B' ' 78' ' ' ASN . 31.5 mmtp -124.12 -42.04 2.17 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.428 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.7 OUTLIER -155.23 153.39 30.58 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.802 -178.191 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 54.9 p -127.69 141.76 51.52 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.231 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -104.67 104.65 46.78 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-O 120.815 0.34 . . . . 0.0 110.63 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.05 132.9 8.65 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 122.213 1.942 . . . . 0.0 111.942 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -95.58 147.36 32.88 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.892 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.48 ' HG2' HD12 ' B' ' 89' ' ' ILE . 34.8 Cg_endo -66.11 139.02 54.15 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.188 1.926 . . . . 0.0 111.396 176.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.02 -5.13 39.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.553 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.89 -20.09 58.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.842 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.48 HD12 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -111.67 137.26 45.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.446 -176.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 6.4 p -88.57 122.71 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 47.5 t -122.55 136.09 60.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.742 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.54 164.15 30.99 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.763 176.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.466 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.04 -22.37 66.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.144 0.497 . . . . 0.0 111.197 -176.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -11.88 57.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.867 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.742 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 15.5 t70 -105.18 -25.06 12.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.511 -177.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.414 HG22 HG13 ' B' ' 98' ' ' ILE . 72.0 mt -75.66 119.13 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.433 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.408 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 11.6 mmmm -113.23 100.34 8.5 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.753 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.448 HD12 ' HB ' ' A' ' 8' ' ' ILE . 45.3 mt -104.44 118.43 51.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 121.026 0.441 . . . . 0.0 111.211 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -129.8 119.02 22.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.574 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.429 ' HB2' HD13 ' B' ' 107' ' ' LEU . 85.2 t60 -101.57 121.49 42.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.81 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.543 HG22 ' H ' ' B' ' 104' ' ' GLU . 76.9 mt -101.86 116.2 45.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . 0.506 ' HD3' ' OE1' ' A' ' 12' ' ' GLU . 21.4 mtm180 -81.2 -39.77 24.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.647 -174.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.41 -32.54 71.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.337 0.589 . . . . 0.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.543 ' H ' HG22 ' B' ' 101' ' ' ILE . 32.6 tt0 -101.36 -5.47 25.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.129 -178.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 34.5 mtm180 51.03 37.77 18.76 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.766 -1.107 . . . . 0.0 111.779 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.411 HG23 ' HB3' ' B' ' 53' ' ' GLU . 45.7 m -128.41 139.68 52.23 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.797 -175.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' B' ' 100' ' ' HIS . 52.5 tp -111.19 117.19 32.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.542 ' CE2' HD11 ' B' ' 51' ' ' LEU . 44.0 m-85 -98.62 124.5 43.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.322 -178.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.473 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 45.0 mm -113.11 117.01 54.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.108 178.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 72.8 m-85 -118.71 127.66 53.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 177.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.6 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 64.1 mt . . . . . 0 C--O 1.248 1.013 0 CA-C-O 119.035 -0.507 . . . . 0.0 109.778 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 21.2 p . . . . . 0 N--CA 1.448 -0.571 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.45 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.4 m -116.76 136.61 53.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.448 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.8 138.11 31.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -176.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.489 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.13 121.11 42.62 Favored Pre-proline 0 C--N 1.319 -0.751 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.351 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.91 135.54 23.54 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 122.58 2.187 . . . . 0.0 112.482 178.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.495 HG13 HG22 ' B' ' 98' ' ' ILE . 26.0 t -98.8 134.75 36.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.982 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.842 HG12 ' HA ' ' B' ' 99' ' ' PHE . 3.6 p -89.6 148.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.526 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -115.27 94.22 4.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.733 0.778 . . . . 0.0 110.237 170.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.429 HG13 HG22 ' A' ' 11' ' ' VAL . 5.1 m -115.43 -171.75 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.358 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.402 ' O ' HG12 ' B' ' 101' ' ' ILE . 6.4 m-20 -99.19 -30.75 12.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -153.82 178.05 10.33 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.406 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.45 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -84.6 149.36 54.18 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.393 173.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.442 ' HG2' ' CE1' ' A' ' 20' ' ' TYR . 39.7 Cg_endo -68.94 165.21 30.76 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.046 1.831 . . . . 0.0 111.472 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.05 135.41 56.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.097 0.475 . . . . 0.0 110.869 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.46 -5.27 29.77 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.815 -174.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' A' ' 17' ' ' PRO . 65.0 m-85 -106.35 176.8 5.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 0.0 111.318 177.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -131.54 97.35 4.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.538 -178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.591 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 64.3 ttp85 . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.501 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 N--CA 1.443 -0.801 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.502 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.9 m-85 -83.11 148.17 27.66 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.753 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -120.37 114.66 22.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.283 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 82.8 t -94.62 125.22 47.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.503 -178.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.487 ' HB2' ' HB2' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -123.23 142.49 50.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.204 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.577 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.5 OUTLIER -127.4 137.83 52.84 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 121.169 -0.212 . . . . 0.0 110.552 -174.504 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.504 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.5 tmtt? -145.58 132.9 20.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.653 0.263 . . . . 0.0 110.362 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.504 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -93.09 139.56 30.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.358 -177.835 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.432 ' CE2' ' HE1' ' B' ' 46' ' ' TYR . 23.9 m-85 -121.49 167.67 12.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.31 176.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -156.4 112.0 2.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.075 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 97.66 16.81 32.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.056 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.09 172.09 7.27 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.7 -18.91 63.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.114 0.483 . . . . 0.0 110.87 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.586 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 2.4 p90 -130.69 147.85 52.41 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.508 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.43 -20.07 14.19 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.203 0.525 . . . . 0.0 109.806 -177.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.577 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -136.23 133.52 37.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.498 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.7 ttp180 -115.83 115.6 26.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.405 176.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.597 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -114.64 131.86 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.572 HD11 ' CD2' ' B' ' 108' ' ' TYR . 4.2 mm? -115.23 122.91 47.44 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.989 -178.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.63 103.46 11.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 176.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.502 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.8 pt-20 -113.05 153.42 28.16 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.072 0.463 . . . . 0.0 110.477 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . 0.435 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -96.37 110.05 22.46 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.885 -177.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -135.67 93.17 2.91 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.509 0.671 . . . . 0.0 110.775 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.26 -179.655 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 38.7 m -133.55 78.8 61.41 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-O 121.009 0.433 . . . . 0.0 110.104 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.592 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 93.2 Cg_endo -82.09 150.89 15.93 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.569 2.179 . . . . 0.0 112.193 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -158.33 144.71 17.31 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.125 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.463 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 45.2 t80 -102.71 118.3 36.54 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.615 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.423 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.1 p-10 -101.18 115.84 31.42 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.753 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -63.8 -26.26 68.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.619 -178.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.13 63.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.784 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.585 ' O ' HG13 ' B' ' 74' ' ' ILE . 11.2 mt-10 -112.08 2.44 16.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.16 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 47.69 46.02 18.12 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.54 1.15 . . . . 0.0 110.811 -174.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.585 HG13 ' O ' ' B' ' 72' ' ' GLU . 84.7 mt -120.85 137.09 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.097 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.434 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.3 tm? -100.11 100.71 11.61 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 177.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.592 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -87.82 137.61 32.19 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.597 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.2 mm -89.79 -49.11 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.403 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -151.59 -177.57 6.18 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.55 0.96 54.03 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.238 -0.982 . . . . 0.0 111.918 176.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -94.25 -34.77 12.74 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.81 0.338 . . . . 0.0 110.411 -176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.4 OUTLIER -157.0 152.39 26.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.802 178.041 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' B' ' 84' ' ' PRO . 35.8 p -128.45 150.0 50.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.105 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -107.77 98.82 26.65 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-O 120.821 0.344 . . . . 0.0 110.553 -179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.541 ' HA ' HG12 ' B' ' 74' ' ' ILE . 14.5 Cg_exo -70.53 135.95 29.81 Favored 'Trans proline' 0 CA--C 1.515 -0.429 0 C-N-CA 122.558 2.172 . . . . 0.0 112.127 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.03 147.84 35.17 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.257 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.457 ' HG2' HD12 ' B' ' 89' ' ' ILE . 36.8 Cg_endo -66.96 139.27 50.8 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.251 1.967 . . . . 0.0 111.64 178.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -7.72 52.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.683 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -80.41 -13.74 58.89 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.636 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.457 HD12 ' HG2' ' B' ' 86' ' ' PRO . 61.1 mt -113.9 133.44 59.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.058 -174.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 8.8 p -83.94 125.57 40.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.464 176.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . 0.463 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.3 p -137.23 137.45 46.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 111.447 -174.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.637 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -139.73 165.62 26.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.618 177.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.45 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -59.54 -25.89 64.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.291 0.567 . . . . 0.0 111.237 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.95 -12.98 59.29 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.637 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 23.0 t0 -106.01 -22.57 12.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 0.0 109.639 -177.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 75.4 mt -76.39 117.11 20.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.9 mmmt -110.96 109.45 19.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.157 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.495 HG22 HG13 ' A' ' 10' ' ' VAL . 50.8 mt -113.48 118.01 57.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 121.206 0.526 . . . . 0.0 111.401 -178.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.842 ' HA ' HG12 ' A' ' 11' ' ' VAL . 73.7 m-85 -128.06 117.67 22.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.475 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.526 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 20.6 t-80 -98.96 110.08 22.74 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.027 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.673 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.7 mp -91.82 109.05 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -81.08 -17.74 49.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.593 -174.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -70.07 -47.61 61.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.14 0.495 . . . . 0.0 110.076 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.673 ' H ' HG22 ' B' ' 101' ' ' ILE . 18.5 mm-40 -86.71 -1.8 58.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.256 177.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 53.02 38.5 27.46 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.576 -176.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.416 HG23 ' HB3' ' B' ' 53' ' ' GLU . 40.1 m -125.88 128.12 47.09 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.099 0.476 . . . . 0.0 110.956 -173.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . 0.425 HD11 ' CG2' ' B' ' 98' ' ' ILE . 45.1 tp -98.9 112.57 24.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.907 177.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.591 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 61.2 m-85 -91.99 123.13 35.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.952 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.597 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.7 mm -112.12 124.9 69.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.961 177.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.496 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 87.8 m-85 -126.9 123.73 37.91 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.586 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.457 -0.783 . . . . 0.0 110.109 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 N--CA 1.451 -0.415 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.504 HG21 ' HB2' ' B' ' 93' ' ' ALA . 21.6 m -130.18 148.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.886 0.374 . . . . 0.0 110.569 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.484 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -92.3 138.96 31.08 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.6 mm -107.73 122.95 39.34 Favored Pre-proline 0 C--N 1.32 -0.677 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.467 -176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.11 129.02 15.55 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.293 1.995 . . . . 0.0 112.015 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.476 HG23 HG22 ' B' ' 98' ' ' ILE . 2.4 p -104.67 135.3 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.311 0.577 . . . . 0.0 110.869 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' B' ' 99' ' ' PHE . 3.5 p -86.53 148.8 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.632 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 44.2 mt-10 -115.23 93.75 4.43 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.565 0.698 . . . . 0.0 110.047 170.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 12.6 m -116.06 -173.44 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.938 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.54 -22.48 16.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.569 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -169.98 172.95 6.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.395 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -76.13 150.53 83.22 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.38 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 51.1 Cg_endo -71.64 172.91 13.42 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 121.948 1.765 . . . . 0.0 111.968 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -53.52 138.53 33.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.315 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.29 -9.61 53.89 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.64 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 60.7 m-85 -99.92 143.07 30.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 0.0 111.969 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -96.2 95.58 8.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.619 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.485 ' HB2' HD23 ' A' ' 16' ' ' LEU . 18.2 ttt180 . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.702 -175.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.431 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 36.8 tt0 . . . . . 0 N--CA 1.449 -0.524 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.481 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -87.56 153.64 21.24 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.496 176.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -125.89 118.18 24.91 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.77 126.87 48.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.869 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.58 119.12 26.29 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.665 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.2 ttt -101.85 139.64 37.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -144.98 131.65 19.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.769 0.319 . . . . 0.0 110.621 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -87.99 143.12 27.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.511 0.672 . . . . 0.0 112.586 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -131.17 152.48 50.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.074 176.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -140.97 116.3 10.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.292 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.98 16.95 58.72 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.148 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.27 172.06 7.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.758 0.313 . . . . 0.0 110.721 -177.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.02 -3.54 16.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.124 0.488 . . . . 0.0 110.864 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.461 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -147.42 140.21 24.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.523 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 3.1 mppt? -94.28 -23.29 17.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.268 0.556 . . . . 0.0 109.646 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.665 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -135.74 134.0 38.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.16 179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -116.54 123.01 46.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.476 174.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.0 mp -119.7 127.83 75.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.514 HD11 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -113.01 118.48 34.94 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -121.81 102.88 12.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 176.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.4 pt-20 -108.79 153.95 22.76 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.353 -178.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -97.67 115.34 27.75 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ptmm? -137.55 91.41 2.59 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.386 176.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . 0.431 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.562 172.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 . . . . . 0 N--CA 1.45 -0.455 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 49.9 m -134.9 78.96 53.02 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 64.3 Cg_endo -78.93 150.27 23.41 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.609 2.206 . . . . 0.0 112.255 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 11.4 m -155.86 147.47 22.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.384 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.46 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.0 t80 -109.8 118.58 36.87 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.709 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.434 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.4 p-10 -99.14 113.2 25.31 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.482 175.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -62.82 -32.66 73.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.907 -175.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.92 72.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.959 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.455 ' O ' HG13 ' B' ' 74' ' ' ILE . 12.1 mm-40 -112.17 1.06 16.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.198 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 47.47 46.55 17.43 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 124.521 1.138 . . . . 0.0 111.487 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.455 HG13 ' O ' ' B' ' 72' ' ' GLU . 59.3 mt -120.5 136.99 55.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.155 -178.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.46 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -103.36 101.31 11.22 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.431 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -88.76 143.52 26.86 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -178.575 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 48.1 mm -96.11 -60.89 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.271 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.32 -171.56 3.87 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.72 2.27 41.23 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.105 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -85.63 -45.78 11.39 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.506 0.67 . . . . 0.0 109.344 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.446 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -159.32 153.45 23.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.134 -176.108 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 26.7 p -124.49 148.43 47.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.799 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.73 102.07 36.36 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.804 0.335 . . . . 0.0 110.456 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.453 ' HA ' HG12 ' B' ' 74' ' ' ILE . 57.6 Cg_endo -74.22 131.82 15.75 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.081 1.854 . . . . 0.0 111.708 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.5 mt -102.28 146.76 32.9 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.236 -175.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -69.05 139.86 43.78 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.194 1.929 . . . . 0.0 111.673 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.26 -3.11 24.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.468 -176.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -81.26 -13.28 58.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.2 mt -112.52 134.72 54.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.684 -177.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 95.3 t -87.52 109.23 19.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . 0.447 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -119.95 135.79 59.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.255 0.55 . . . . 0.0 111.11 -173.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.487 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -139.82 165.82 26.27 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 179.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.504 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.89 -20.3 63.59 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.491 0.494 . . . . 0.0 111.682 -176.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.7 -14.12 46.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.487 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 28.7 t0 -105.78 -23.97 12.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.723 0.773 . . . . 0.0 109.768 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.09 117.08 14.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.387 177.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 25.7 mmmt -110.91 108.27 18.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.091 178.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.476 HG22 HG23 ' A' ' 10' ' ' VAL . 54.3 mt -112.74 119.74 61.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.203 -177.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.833 ' HA ' HG12 ' A' ' 11' ' ' VAL . 75.7 m-85 -128.71 117.01 20.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.87 -178.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.514 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 17.4 t-80 -98.55 113.83 26.01 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.905 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.605 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.8 mp -91.11 126.07 43.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 75.1 mtm180 -80.72 -45.43 17.11 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.354 -173.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.74 -47.5 83.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -177.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.605 ' H ' HG22 ' B' ' 101' ' ' ILE . 45.2 mm-40 -81.62 -1.05 45.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 104' ' ' GLU . 12.5 ptm180 44.12 41.79 4.44 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.166 0.916 . . . . 0.0 111.42 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -127.46 141.77 51.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.834 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.76 118.66 35.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.41 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.514 ' CE2' HD11 ' B' ' 51' ' ' LEU . 38.4 m-85 -98.62 131.48 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.36 -179.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.6 mm -119.74 123.01 70.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.068 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.416 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 89.1 m-85 -123.53 130.39 52.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 176.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.461 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.915 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.9 p . . . . . 0 N--CA 1.451 -0.405 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.47 HG21 ' HB2' ' B' ' 93' ' ' ALA . 28.0 m -128.32 152.24 36.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.552 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -93.05 136.88 32.91 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.4 mm -106.5 124.11 36.7 Favored Pre-proline 0 C--N 1.319 -0.745 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.186 -178.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.3 136.87 32.6 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.403 2.069 . . . . 0.0 112.067 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.504 HG23 HG22 ' B' ' 98' ' ' ILE . 2.5 p -114.3 134.11 58.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.267 0.556 . . . . 0.0 110.744 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.825 HG12 ' HA ' ' B' ' 99' ' ' PHE . 4.1 p -89.09 149.12 4.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.664 -179.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.52 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 47.5 mt-10 -107.59 94.92 5.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 169.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 9.0 m -117.28 -176.11 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.586 -178.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -104.07 -29.68 10.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 176.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -151.93 166.46 31.42 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.01 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.403 HD22 ' H ' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -84.04 151.33 60.21 Favored Pre-proline 0 N--CA 1.444 -0.736 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.879 177.402 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -53.69 167.57 0.97 Allowed 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 123.523 2.816 . . . . 0.0 113.588 175.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -63.21 130.14 43.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.639 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.6 -9.75 38.16 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.797 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.1 164.1 13.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 111.561 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -103.57 153.83 20.16 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.373 175.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 ttp85 . . . . . 0 C--N 1.321 -0.646 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 171.281 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.455 ' N ' ' HB2' ' B' ' 56' ' ' ALA . 31.0 tt0 . . . . . 0 N--CA 1.446 -0.638 0 CA-C-O 121.472 0.653 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.433 ' HB2' HD21 ' B' ' 81' ' ' LEU . 90.3 m-85 -85.23 146.14 27.22 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.771 179.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.425 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 29.7 tt0 -119.16 108.5 14.74 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 176.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.4 p -96.98 137.25 25.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.48 -175.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.51 146.28 50.87 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.155 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.476 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -126.13 143.08 51.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.519 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 7.8 tmtm? -147.03 137.99 23.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -176.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.509 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 8.0 mpt_? -99.08 139.48 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.02 0.438 . . . . 0.0 110.725 -178.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.519 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.8 m-85 -127.02 157.07 40.56 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.222 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.444 ' NZ ' ' HB2' ' B' ' 42' ' ' LYS . 0.0 OUTLIER -156.75 110.18 2.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.654 175.181 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 113.98 -1.34 24.27 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.14 171.83 7.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.567 -0.316 . . . . 0.0 110.328 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.86 -18.48 64.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.201 0.524 . . . . 0.0 110.779 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.593 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -126.39 143.04 51.31 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.805 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.513 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.54 -17.48 15.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.164 0.507 . . . . 0.0 109.832 -176.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.626 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -141.21 132.74 26.97 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.157 179.306 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.623 ' HG3' ' CE1' ' B' ' 110' ' ' TYR . 19.3 ttp180 -115.65 129.27 56.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.794 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.626 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -125.82 127.13 71.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 176.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.514 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 0.9 OUTLIER -115.32 119.55 36.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.195 -177.032 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.16 104.21 14.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.43 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.3 pt-20 -107.78 152.22 24.66 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -103.83 116.12 31.71 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.898 0.38 . . . . 0.0 110.661 -178.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -137.72 93.27 2.77 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.694 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . 0.455 ' HB2' ' N ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.253 176.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 . . . . . 0 CA--C 1.513 -0.464 0 CA-C-O 120.754 0.312 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.3 p -135.12 79.54 50.04 Favored Pre-proline 0 C--N 1.317 -0.808 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.498 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.9 Cg_endo -79.44 145.83 18.97 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.379 2.052 . . . . 0.0 112.338 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.2 m -153.42 147.74 25.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.45 -177.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.495 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.5 t80 -113.01 127.64 56.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.081 0.467 . . . . 0.0 111.043 -176.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.472 HD21 ' HB ' ' B' ' 74' ' ' ILE . 2.2 p-10 -105.33 116.46 31.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.172 174.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -65.9 -32.89 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.608 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.32 -53.3 55.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.535 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.527 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -105.74 7.96 32.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.713 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.72 42.37 19.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.128 0.971 . . . . 0.0 111.752 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.527 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.6 mt -116.04 137.89 48.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.489 -178.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.495 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -108.14 107.02 17.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -94.07 136.36 34.44 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.211 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 34.5 mm -90.98 -47.93 14.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.107 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -159.2 175.61 13.23 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 -173.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.24 9.65 12.73 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.296 174.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -99.54 -37.69 9.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.433 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -162.47 153.69 17.77 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.492 0.663 . . . . 0.0 112.003 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.9 t -129.42 147.89 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.909 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mm -111.39 106.67 57.12 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.999 0.428 . . . . 0.0 110.966 -175.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -74.94 134.36 17.82 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.155 1.903 . . . . 0.0 111.67 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 74.6 mt -102.37 154.95 37.07 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.684 -175.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.469 ' HG2' HD12 ' B' ' 89' ' ' ILE . 40.1 Cg_endo -68.95 141.88 49.88 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.229 1.953 . . . . 0.0 111.865 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.92 -3.14 46.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.486 -176.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.62 -9.36 56.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.287 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.469 HD12 ' HG2' ' B' ' 86' ' ' PRO . 61.2 mt -114.04 134.19 57.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.478 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.25 111.66 22.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 58.6 t -116.05 133.7 61.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.145 0.498 . . . . 0.0 111.038 -173.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.478 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.36 160.75 39.47 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.405 177.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.47 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.97 -20.62 64.04 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.173 0.511 . . . . 0.0 111.588 -176.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -12.99 56.66 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.249 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.478 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.9 t70 -110.07 -24.31 10.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.493 0.663 . . . . 0.0 109.812 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 86.7 mt -69.69 118.35 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.168 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -112.98 107.38 15.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.9 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.504 HG22 HG23 ' A' ' 10' ' ' VAL . 56.8 mt -110.28 121.76 63.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 111.428 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.825 ' HA ' HG12 ' A' ' 11' ' ' VAL . 78.8 m-85 -129.12 118.84 23.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.199 -179.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.52 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 23.8 t-80 -104.44 108.64 20.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.136 0.493 . . . . 0.0 110.41 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.638 HG22 ' H ' ' B' ' 104' ' ' GLU . 66.2 mt -86.73 98.61 7.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.439 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . 0.434 ' HD2' ' OE2' ' A' ' 12' ' ' GLU . 14.2 ptm180 -74.8 -10.96 60.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.508 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.39 -43.15 74.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.386 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.638 ' H ' HG22 ' B' ' 101' ' ' ILE . 30.0 mm-40 -99.9 -6.86 26.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.454 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 61.35 36.96 17.3 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.502 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.43 HG23 ' HB3' ' B' ' 53' ' ' GLU . 19.4 m -123.26 142.26 51.11 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.373 -176.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.15 121.59 44.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.161 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.529 ' CE1' HD12 ' B' ' 101' ' ' ILE . 17.7 m-85 -106.17 130.19 54.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.163 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.575 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.4 mm -118.11 124.43 73.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.623 ' CE1' ' HG3' ' B' ' 49' ' ' ARG . 98.9 m-85 -128.62 125.02 37.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.908 0.385 . . . . 0.0 110.288 177.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.593 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 56.2 mt . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.648 -0.692 . . . . 0.0 109.718 -179.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.8 p . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.511 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.6 m -121.38 138.79 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.047 0.451 . . . . 0.0 111.659 -173.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -85.23 138.27 32.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.843 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.573 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.06 117.44 51.81 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -177.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.75 128.28 17.68 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.427 2.085 . . . . 0.0 112.38 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 43.5 t -91.78 131.38 39.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.665 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.8 HG12 ' HA ' ' B' ' 99' ' ' PHE . 2.3 p -87.08 147.57 5.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.573 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.0 mt-10 -115.29 93.98 4.53 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 119.705 -0.798 . . . . 0.0 109.682 168.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.418 HG13 HG22 ' A' ' 11' ' ' VAL . 6.9 m -110.92 -179.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.637 -176.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -86.25 -32.63 21.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.527 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.7 pt-20 -170.48 172.05 6.19 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.678 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.415 ' H ' HD22 ' A' ' 16' ' ' LEU . 1.0 OUTLIER -76.7 144.08 72.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-O 120.542 0.21 . . . . 0.0 110.45 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 40.0 Cg_endo -68.08 172.53 10.78 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.278 1.986 . . . . 0.0 111.955 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -57.05 133.64 55.14 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.488 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.25 -11.31 31.25 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.245 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 63.4 m-85 -97.58 159.49 14.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -114.81 95.23 5.12 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.792 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.061 177.795 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 . . . . . 0 N--CA 1.444 -0.748 0 CA-C-O 121.417 0.627 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.2 m-85 -86.89 138.58 31.43 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.487 175.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.45 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 22.8 tt0 -118.75 110.04 16.79 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.1 p -97.53 131.71 43.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.358 -174.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.45 ' HE2' ' HG2' ' B' ' 35' ' ' GLU . 0.1 OUTLIER -124.0 132.34 53.69 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.509 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.536 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -113.79 143.24 44.98 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.782 -176.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.525 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 7.0 tmtm? -149.47 135.49 18.88 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.12 -0.232 . . . . 0.0 110.473 -176.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.525 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER -92.28 128.98 38.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.009 0.433 . . . . 0.0 111.017 178.419 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.481 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 11.3 m-85 -114.56 138.98 49.97 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.805 176.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -138.55 106.61 5.72 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.164 0.506 . . . . 0.0 109.719 176.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 122.19 2.84 9.93 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.741 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -114.6 171.63 7.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.76 -21.06 65.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.341 0.591 . . . . 0.0 110.551 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.674 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.8 p90 -119.28 141.65 48.78 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.789 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.493 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.6 mppt? -105.42 -15.39 15.03 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.454 0.645 . . . . 0.0 109.81 -175.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.654 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.11 130.42 28.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.889 177.503 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 17.8 ttp180 -119.47 123.5 44.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.892 177.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.654 HD11 HD12 ' B' ' 48' ' ' LEU . 1.9 mp -120.54 127.21 75.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.5 mm? -110.1 112.27 24.15 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.046 -178.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -120.02 103.88 14.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.458 ' HB3' HG23 ' B' ' 106' ' ' THR . 15.6 pt-20 -109.58 153.3 24.36 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.633 -178.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . 0.405 ' HA ' HD22 ' B' ' 54' ' ' ASN . 2.3 t-20 -95.56 108.12 20.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.723 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -135.39 92.37 2.84 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.41 0.624 . . . . 0.0 110.255 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.806 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.938 176.632 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 . . . . . 0 CA--C 1.517 -0.326 0 CA-C-O 120.939 0.4 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 41.5 m -138.67 80.3 26.31 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.863 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.475 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 90.1 Cg_endo -82.92 162.23 15.93 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.87 2.38 . . . . 0.0 112.213 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.5 p -162.71 136.49 6.16 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -98.23 115.76 29.04 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.492 -179.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.49 114.71 26.39 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.706 176.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -63.66 -25.05 68.04 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.428 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.86 71.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.845 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.474 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.56 3.91 17.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.358 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . 0.574 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.5 p-10 47.54 45.33 17.51 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.472 1.107 . . . . 0.0 111.469 -174.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.474 HG13 ' O ' ' B' ' 72' ' ' GLU . 64.6 mt -123.17 137.11 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.01 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -107.17 103.72 13.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.2 OUTLIER -91.43 141.49 28.69 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.732 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . 0.475 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 33.7 mm -95.27 -48.36 12.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.628 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.466 ' C ' ' H ' ' B' ' 80' ' ' LYS . 9.1 t-20 -155.97 171.94 19.23 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.076 -171.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.15 38.65 1.15 Allowed Glycine 0 C--O 1.228 -0.228 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 176.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . 0.466 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.2 mmtt -130.45 -41.1 1.23 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -157.95 153.97 27.04 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.205 -175.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 49.1 p -125.61 145.42 50.15 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.226 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.0 mm -111.55 100.43 47.89 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.7 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -71.4 142.82 41.74 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.77 2.313 . . . . 0.0 112.036 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.21 142.54 25.08 Favored Pre-proline 0 C--N 1.318 -0.783 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.016 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.492 ' HG2' HD12 ' B' ' 89' ' ' ILE . 24.9 Cg_endo -63.45 139.24 69.72 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.242 1.962 . . . . 0.0 111.281 176.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.574 ' NE ' HD21 ' B' ' 73' ' ' ASN . 8.7 mpt_? -74.31 -3.18 28.68 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.259 -174.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -80.58 -19.35 45.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.524 0.678 . . . . 0.0 109.566 178.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.492 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.6 mt -104.1 131.48 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.61 -176.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.0 t -84.57 110.23 18.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 1.7 p -120.74 132.44 70.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 121.468 0.652 . . . . 0.0 111.41 -172.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.544 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.81 164.6 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.194 179.144 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.511 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.51 -21.28 64.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.692 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.94 -15.81 52.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.042 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.544 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 19.1 t0 -106.81 -21.91 12.88 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.65 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.7 mt -74.79 119.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.267 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.497 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.4 mmmt -113.64 106.42 14.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.065 179.045 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.573 HD12 ' HB ' ' A' ' 8' ' ' ILE . 49.8 mt -109.99 121.75 63.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.174 0.511 . . . . 0.0 111.177 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.8 ' HA ' HG12 ' A' ' 11' ' ' VAL . 53.9 m-85 -130.94 124.32 30.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.132 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.573 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 26.9 t-80 -106.38 117.03 32.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.039 0.447 . . . . 0.0 110.578 177.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.611 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.0 mt -99.58 104.84 16.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 172.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.49 -21.58 48.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.403 -174.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -68.81 -43.68 75.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.016 0.436 . . . . 0.0 110.496 176.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.611 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.1 mm-40 -87.73 -7.17 57.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.284 0.564 . . . . 0.0 110.088 177.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 57.06 35.87 26.93 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.51 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.458 HG23 ' HB3' ' B' ' 53' ' ' GLU . 33.2 m -124.43 138.49 54.35 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.623 -174.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.76 123.05 48.85 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.603 ' CE1' HD12 ' B' ' 101' ' ' ILE . 19.4 m-85 -105.73 129.59 53.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.854 -176.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.2 mm -117.37 119.62 62.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.858 177.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.47 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.7 m-85 -122.49 122.7 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 176.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.674 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 68.0 mt . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.902 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 4.2 m . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.992 -0.374 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' B' ' 93' ' ' ALA . 31.5 m -123.52 150.0 27.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.027 0.441 . . . . 0.0 110.721 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.56 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -91.4 139.66 30.51 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.762 179.099 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.474 ' HB ' HD12 ' B' ' 98' ' ' ILE . 6.0 mm -110.42 119.54 46.48 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.137 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.47 128.44 17.24 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.099 1.866 . . . . 0.0 112.207 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 HG22 ' B' ' 98' ' ' ILE . 2.6 p -105.21 135.48 43.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.811 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.679 HG21 ' HD1' ' B' ' 99' ' ' PHE . 0.9 OUTLIER -86.59 150.04 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.044 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.613 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 35.2 mt-10 -116.58 94.77 4.75 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.862 168.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 16.6 m -114.86 -171.3 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.508 -177.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -103.4 -23.15 13.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.797 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.425 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.6 pt-20 -170.27 161.68 8.33 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.204 176.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.6 150.03 69.18 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.504 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -72.96 174.17 12.39 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.805 2.337 . . . . 0.0 112.142 176.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -59.66 146.09 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.983 0.421 . . . . 0.0 110.503 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.6 -16.36 54.92 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 111.211 -0.755 . . . . 0.0 111.211 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.33 153.41 18.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -110.51 100.88 9.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.114 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 . . . . . 0 C--N 1.319 -0.723 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.124 -179.954 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 . . . . . 0 N--CA 1.443 -0.8 0 CA-C-O 121.533 0.682 . . . . 0.0 109.733 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 94.3 m-85 -85.07 157.05 20.82 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.767 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.45 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 37.7 tt0 -126.34 112.11 15.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.252 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.3 t -93.55 128.61 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 O-C-N 123.469 0.481 . . . . 0.0 111.183 -177.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.45 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -129.86 119.53 23.47 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.43 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.546 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -104.35 140.56 37.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.431 -175.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.463 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 2.2 tmtp? -149.26 138.08 21.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 110.696 -174.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.479 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 8.6 mpt_? -98.75 135.84 39.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.201 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.463 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 26.6 m-85 -115.14 143.51 45.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.188 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -127.56 101.92 6.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.336 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.55 32.04 6.17 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.541 -0.837 . . . . 0.0 112.519 178.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.19 172.1 10.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.84 -27.26 63.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.447 0.641 . . . . 0.0 110.531 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.661 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.3 p90 -120.59 143.87 48.41 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.748 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.503 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.7 mppt? -101.82 -22.35 14.38 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.418 -176.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.603 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.94 132.92 31.12 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.815 -178.423 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -119.75 129.57 54.56 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.603 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -124.7 127.96 73.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.494 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.1 mm? -111.04 121.54 45.62 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 4.5 mp -126.18 102.67 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 177.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.8 pt-20 -112.34 154.34 25.87 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.12 0.486 . . . . 0.0 110.628 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -99.1 111.35 23.76 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.535 -176.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.79 92.57 2.91 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.504 0.669 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.287 176.51 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 120.822 0.344 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -138.8 79.81 26.97 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-O 121.231 0.539 . . . . 0.0 109.745 175.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.463 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 66.8 Cg_endo -77.1 150.81 29.88 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.735 2.29 . . . . 0.0 112.345 -178.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 17.0 m -153.57 143.63 22.12 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.338 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.416 ' HB2' HD23 ' B' ' 75' ' ' LEU . 63.1 t80 -104.54 113.4 26.94 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.296 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.504 HD21 ' HB ' ' B' ' 74' ' ' ILE . 0.8 OUTLIER -95.57 108.26 20.5 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.502 177.128 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -60.03 -28.35 67.68 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.19 -44.37 64.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.248 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.512 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.4 mt-10 -114.15 3.38 15.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.996 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 47.8 43.74 17.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.068 0.947 . . . . 0.0 111.453 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.512 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.0 mt -121.93 138.09 53.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.142 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.416 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -100.42 101.68 12.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.463 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -89.19 139.48 30.44 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.511 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.8 mm -91.73 -53.23 9.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.499 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.4 p30 -162.48 -165.99 1.28 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.866 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.63 0.59 69.91 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.686 178.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -92.22 -42.4 9.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.491 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -158.63 153.74 25.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.935 -178.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 31.3 t -133.53 150.2 51.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.325 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.4 mm -114.79 105.73 52.88 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.999 0.428 . . . . 0.0 110.95 -174.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.29 136.06 11.12 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.422 2.082 . . . . 0.0 112.599 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.73 146.67 32.25 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.102 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.51 ' HG2' HD12 ' B' ' 89' ' ' ILE . 23.3 Cg_endo -62.49 141.7 87.59 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.459 2.106 . . . . 0.0 111.654 176.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -73.88 -7.06 50.85 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.55 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . 0.502 ' OD1' ' HB2' ' B' ' 86' ' ' PRO . 4.6 p-10 -89.29 -4.19 58.23 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.876 0.37 . . . . 0.0 110.781 -178.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.51 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.7 mt -112.29 135.55 51.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.318 179.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -87.21 116.34 29.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.299 0.571 . . . . 0.0 110.19 177.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 54.1 t -121.91 133.56 67.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.293 0.568 . . . . 0.0 111.184 -174.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.474 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.27 159.3 42.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.566 177.915 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.451 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -64.12 -16.67 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.875 -175.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.73 -14.14 49.21 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.025 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.474 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 27.4 t70 -109.31 -22.35 12.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.353 0.597 . . . . 0.0 109.978 -177.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.436 HG22 HG13 ' B' ' 98' ' ' ILE . 85.6 mt -71.4 117.42 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.619 176.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.469 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 26.0 mmmt -112.28 104.7 12.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.677 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.545 HG22 HG23 ' A' ' 10' ' ' VAL . 53.5 mt -108.87 117.89 55.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.198 0.523 . . . . 0.0 111.48 -177.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.679 ' HD1' HG21 ' A' ' 11' ' ' VAL . 96.1 m-85 -127.78 121.96 31.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.451 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 t-80 -104.93 123.13 47.22 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 110.173 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.741 HG22 ' H ' ' B' ' 104' ' ' GLU . 52.4 mt -99.05 120.65 48.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.154 0.502 . . . . 0.0 109.846 175.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' B' ' 102' ' ' ARG . 3.9 ptt180 -75.77 -35.91 59.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.756 -176.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.28 -41.27 66.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.101 0.477 . . . . 0.0 110.53 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.741 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.3 tp10 -81.09 -10.9 59.6 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.397 -178.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 30.5 mmm180 58.57 29.49 18.52 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.11 -178.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.485 HG23 ' HB3' ' B' ' 53' ' ' GLU . 85.4 m -127.08 139.77 52.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.59 -168.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.49 120.64 43.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.521 177.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.494 ' CE2' HD11 ' B' ' 51' ' ' LEU . 23.7 m-85 -101.33 125.29 47.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.714 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.508 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.8 mm -113.64 116.39 52.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.114 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 80.2 m-85 -117.36 124.55 49.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 175.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.661 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.0 mt . . . . . 0 C--O 1.245 0.834 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.592 178.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.452 -0.346 0 CA-C-O 120.733 0.302 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.413 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.3 m -130.42 142.15 44.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.345 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.41 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -86.93 137.72 32.13 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.684 0.278 . . . . 0.0 110.251 -178.306 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.403 HG12 ' HA ' ' B' ' 67' ' ' SER . 4.5 mm -110.32 120.57 43.87 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -76.81 135.35 15.77 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.243 1.962 . . . . 0.0 112.068 177.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.1 t -85.06 132.93 30.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.605 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.499 HG12 HG13 ' A' ' 13' ' ' VAL . 82.0 t -95.93 112.21 27.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 172.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.523 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 40.7 mt-10 -91.42 110.15 21.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.453 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.499 HG13 HG12 ' A' ' 11' ' ' VAL . 2.5 m -130.31 -176.18 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.662 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -84.09 -30.04 26.3 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -172.78 -178.65 1.92 Allowed 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.158 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.468 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.4 mm? -77.46 150.83 80.09 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-O 120.808 0.337 . . . . 0.0 110.129 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -65.39 172.63 7.48 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.544 2.163 . . . . 0.0 111.535 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.94 139.67 56.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.354 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.21 -15.38 50.86 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.94 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -84.64 173.29 10.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.762 0.315 . . . . 0.0 110.459 176.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -126.89 100.07 6.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.989 0.423 . . . . 0.0 110.826 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.468 ' HB2' HD23 ' A' ' 16' ' ' LEU . 56.7 ttp85 . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.286 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 . . . . . 0 N--CA 1.445 -0.715 0 CA-C-O 121.348 0.594 . . . . 0.0 109.527 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.0 m-85 -83.35 144.05 29.93 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.13 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -120.54 114.43 21.74 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 60.4 t -96.96 129.43 47.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.47 -174.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.419 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -123.0 136.37 54.83 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.744 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.728 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.7 OUTLIER -117.1 127.34 54.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.95 0.405 . . . . 0.0 110.922 -179.274 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.651 ' O ' HD13 ' B' ' 48' ' ' LEU . 7.3 tmtm? -125.42 118.48 25.96 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -175.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.419 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 6.6 mpt_? -90.09 127.12 36.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.257 0.551 . . . . 0.0 111.52 -172.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.592 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 25.5 m-85 -109.28 167.74 9.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.86 176.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.92 127.17 9.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.465 174.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 74.56 33.75 55.35 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.472 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.17 172.18 10.77 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.768 -0.254 . . . . 0.0 110.401 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.52 -22.96 65.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.293 0.568 . . . . 0.0 110.5 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.645 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -130.83 142.06 50.37 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.958 178.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.504 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.99 -19.21 18.16 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.059 0.457 . . . . 0.0 109.83 -176.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.728 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.0 OUTLIER -143.22 134.74 26.3 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.234 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.401 ' HB2' ' CE1' ' B' ' 41' ' ' PHE . 34.4 ttp180 -113.73 113.0 24.37 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 171.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.583 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.1 mp -108.34 127.86 64.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.8 mm? -110.12 117.96 35.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.282 -177.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.93 103.71 13.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 16.5 pt-20 -113.23 153.79 27.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.968 0.413 . . . . 0.0 110.543 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . 0.438 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -96.85 112.67 24.32 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.899 -177.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -138.43 91.32 2.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.027 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.659 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.947 172.802 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 . . . . . 0 CA--C 1.509 -0.627 0 CA-C-O 121.665 0.745 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 19.4 t -142.23 78.96 16.36 Favored Pre-proline 0 C--N 1.305 -1.337 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.803 172.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.415 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 71.9 Cg_endo -78.65 156.64 28.05 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.937 2.425 . . . . 0.0 112.402 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . 0.473 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 20.3 m -158.51 144.88 17.18 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.229 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.451 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.7 t80 -106.39 119.04 38.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.583 -177.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.404 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.0 OUTLIER -100.02 113.47 26.08 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.37 175.759 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -62.71 -32.09 73.13 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.631 -177.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.62 -50.12 63.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.666 -178.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 3.0 mm-40 -103.6 1.6 32.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.391 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 46.97 46.07 15.67 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 124.375 1.047 . . . . 0.0 111.537 -175.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.7 mt -124.0 138.41 53.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.191 -178.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.451 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -104.82 102.26 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.473 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -88.75 138.6 31.27 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.59 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . 0.415 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 34.9 mm -92.3 -46.53 14.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.084 -175.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -150.26 -179.94 7.61 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.65 1.94 60.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.585 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -101.35 -33.97 9.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.626 -0.287 . . . . 0.0 111.146 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -154.4 153.32 31.39 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.309 0.576 . . . . 0.0 112.226 178.543 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 33.1 p -129.73 151.78 49.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.178 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mm -111.9 105.01 56.51 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 120.849 0.357 . . . . 0.0 110.514 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -80.34 135.78 10.91 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.632 2.221 . . . . 0.0 112.713 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -103.14 148.26 35.37 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.17 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.431 ' HG2' HD12 ' B' ' 89' ' ' ILE . 32.6 Cg_endo -66.63 137.73 47.07 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.18 1.92 . . . . 0.0 111.389 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.465 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 0.0 OUTLIER -70.5 -3.99 20.62 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.739 -175.832 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.62 -11.58 58.29 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.465 0.65 . . . . 0.0 109.972 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.431 HD12 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -107.59 132.04 56.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.534 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 57.8 t -82.91 110.59 18.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 175.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 49.1 t -115.34 132.77 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.67 -174.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.608 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.27 162.2 36.04 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.617 177.481 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.413 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.63 -17.82 63.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.89 -175.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.26 -16.41 40.25 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.794 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.608 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 21.0 t0 -104.57 -23.07 13.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.547 0.689 . . . . 0.0 109.672 -176.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.44 114.6 13.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.969 177.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.426 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 24.1 mmmt -108.56 105.96 15.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.808 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 48.9 mt -109.38 116.18 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.373 . . . . 0.0 110.856 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.427 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.7 m-85 -129.39 119.83 24.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -177.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.523 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.8 t-80 -102.62 114.2 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.552 HG22 ' H ' ' B' ' 104' ' ' GLU . 4.2 mp -95.87 101.14 12.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 171.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -78.5 -15.8 58.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.471 -174.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.44 -41.64 80.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.877 0.37 . . . . 0.0 110.152 175.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.552 ' H ' HG22 ' B' ' 101' ' ' ILE . 13.6 mm-40 -94.32 -3.67 50.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.493 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 59.15 35.78 23.79 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.404 -177.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.424 HG23 ' HB3' ' B' ' 53' ' ' GLU . 27.6 m -125.63 134.75 51.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.982 0.42 . . . . 0.0 110.866 -173.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 49.3 tp -108.63 117.49 34.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.232 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.553 ' CE2' HD11 ' B' ' 51' ' ' LEU . 35.7 m-85 -97.78 129.1 44.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.081 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.58 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 42.2 mm -116.06 123.1 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.961 176.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 83.7 m-85 -121.34 127.54 51.38 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.645 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 65.3 mt . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.594 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.3 p . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 120.61 0.243 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.529 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.2 m -127.45 144.37 37.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.676 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -84.98 138.68 32.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.7 mm -107.56 119.85 49.26 Favored Pre-proline 0 C--N 1.321 -0.656 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.119 178.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.38 135.62 24.86 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.557 2.171 . . . . 0.0 112.575 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -93.54 124.23 45.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.566 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.454 HG12 HG13 ' A' ' 13' ' ' VAL . 58.7 t -92.55 118.47 38.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.439 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.8 mt-10 -94.0 111.02 22.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.379 0.609 . . . . 0.0 110.269 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.454 HG13 HG12 ' A' ' 11' ' ' VAL . 2.7 m -127.74 -175.81 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.107 -177.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -85.97 -29.75 23.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.519 ' HA ' HG12 ' B' ' 101' ' ' ILE . 13.0 pt-20 -178.28 175.26 1.21 Allowed 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.077 173.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.463 ' H ' HD22 ' A' ' 16' ' ' LEU . 1.8 mm? -71.88 153.62 92.96 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.788 0.327 . . . . 0.0 111.119 -174.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.81 173.04 15.1 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.193 1.929 . . . . 0.0 111.446 174.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.25 138.76 57.87 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.619 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.61 -10.46 41.89 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.831 -175.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.4 ' HA ' ' OH ' ' B' ' 46' ' ' TYR . 60.6 m-85 -103.92 152.65 21.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.992 0.425 . . . . 0.0 111.598 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -112.91 104.0 11.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.327 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.626 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 63.7 ttp85 . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.159 -176.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.496 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 41.9 tt0 . . . . . 0 N--CA 1.447 -0.62 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.494 ' HB2' HD21 ' B' ' 81' ' ' LEU . 81.4 m-85 -87.35 155.98 19.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.927 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -130.21 118.06 20.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.961 175.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -95.96 138.89 20.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.822 -174.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.482 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -132.52 151.75 51.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 175.312 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -132.77 141.7 48.64 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 8.7 tmtm? -144.88 135.76 24.74 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.636 -176.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.488 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 7.6 mpt_? -98.61 129.48 45.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.995 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.474 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 31.3 m-85 -107.91 146.9 31.73 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.5 177.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -129.37 100.11 5.45 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.903 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 93.39 45.19 3.55 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.203 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -133.45 170.74 15.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.78 -17.04 63.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.281 0.562 . . . . 0.0 110.776 177.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.536 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -130.34 140.16 50.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . 0.538 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -95.28 -24.37 16.8 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.226 0.536 . . . . 0.0 109.668 -174.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.588 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.59 136.76 37.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.249 -177.3 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -120.72 129.58 53.7 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.588 HD11 HD12 ' B' ' 48' ' ' LEU . 2.6 mp -123.03 129.85 74.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.0 mm? -114.26 118.89 35.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.51 -175.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -124.36 103.53 12.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.53 ' HB3' HG23 ' B' ' 106' ' ' THR . 13.1 pt-20 -107.22 153.65 22.38 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.579 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.23 112.46 24.61 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.646 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -136.88 92.82 2.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.37 0.605 . . . . 0.0 110.682 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . 0.496 ' HB2' ' HB3' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.322 -0.589 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.178 176.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 . . . . . 0 N--CA 1.451 -0.406 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.7 p -136.38 79.46 42.25 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.169 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.404 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 91.4 Cg_endo -87.8 153.86 7.37 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.828 2.352 . . . . 0.0 112.391 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . 0.418 ' HA ' HG12 ' A' ' 8' ' ' ILE . 24.7 m -157.18 150.29 23.74 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.501 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.421 ' HB2' HD23 ' B' ' 75' ' ' LEU . 48.8 t80 -109.05 125.45 52.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.507 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -106.54 117.93 35.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -70.17 -14.92 62.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.828 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.13 -50.94 71.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.101 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.434 ' O ' HD13 ' B' ' 74' ' ' ILE . 6.3 mm-40 -113.36 0.1 14.68 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.307 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' B' ' 85' ' ' LEU . 1.8 p-10 51.35 48.28 23.27 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 124.712 1.257 . . . . 0.0 111.014 -171.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' B' ' 84' ' ' PRO . 0.3 OUTLIER -107.27 146.97 12.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.736 177.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.427 ' HB2' HD11 ' B' ' 85' ' ' LEU . 3.2 tm? -115.72 102.38 9.68 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.1 OUTLIER -91.07 139.93 30.3 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -178.565 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.0 mm -93.25 -46.42 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.618 -174.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.429 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.2 t-20 -161.93 178.59 8.75 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -175.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.17 32.83 1.31 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.195 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' B' ' 78' ' ' ASN . 28.2 mmmt -125.07 -44.66 1.9 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.494 HD21 ' HB2' ' B' ' 34' ' ' TYR . 1.0 OUTLIER -152.25 153.65 34.18 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.784 -177.978 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 13.3 p -126.52 145.82 50.36 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.055 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.6 mm -107.83 111.07 62.55 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.603 -178.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.602 ' HA ' HD12 ' B' ' 74' ' ' ILE . 59.8 Cg_endo -75.69 132.8 14.88 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.992 1.795 . . . . 0.0 111.899 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 78.7 mt -102.6 148.26 35.25 Favored Pre-proline 0 C--N 1.323 -0.561 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.773 -176.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.93 142.93 43.89 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.739 2.293 . . . . 0.0 112.327 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.431 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 9.1 mpt_? -79.07 -6.48 56.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.931 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -79.52 -18.83 51.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.639 0.733 . . . . 0.0 109.714 179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 55.8 mt -107.56 131.5 57.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.773 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.2 115.83 27.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . 0.411 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -126.24 134.85 65.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.324 0.583 . . . . 0.0 111.222 -173.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . 0.45 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.79 164.91 28.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.855 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.529 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.77 -16.85 62.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.867 -175.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.48 -12.41 43.08 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.177 0.513 . . . . 0.0 110.905 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . 0.45 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 25.5 t0 -109.24 -26.87 9.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.951 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . 0.406 HG22 HG13 ' B' ' 98' ' ' ILE . 82.5 mt -69.79 114.98 7.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.04 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.414 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.1 mmmt -108.45 103.42 12.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.401 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.428 HD12 ' HB ' ' A' ' 8' ' ' ILE . 40.4 mt -107.14 121.51 60.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.796 179.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.436 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 76.3 m-85 -134.56 121.2 20.61 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.275 -178.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.439 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 17.5 t-80 -96.34 110.75 23.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.463 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.811 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.2 mp -91.87 107.55 18.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 173.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -73.85 -23.19 59.58 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.971 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -60.64 -47.59 85.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.164 0.507 . . . . 0.0 110.643 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.811 ' H ' HG22 ' B' ' 101' ' ' ILE . 15.6 mm-40 -92.61 -3.42 55.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.641 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 57.99 34.39 24.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.128 -176.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.53 HG23 ' HB3' ' B' ' 53' ' ' GLU . 41.2 m -129.16 141.6 51.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.201 -170.213 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.8 tp -107.12 120.31 41.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.007 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.706 ' CD1' HD13 ' B' ' 101' ' ' ILE . 21.2 m-85 -102.6 130.61 49.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.014 -178.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.571 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.5 mm -115.49 120.23 64.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.9 177.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.441 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.7 m-85 -121.01 126.66 50.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.536 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.646 -0.692 . . . . 0.0 109.82 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 2.0 m . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.515 HG21 ' HB2' ' B' ' 93' ' ' ALA . 24.4 m -135.33 152.87 32.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.705 0.288 . . . . 0.0 110.647 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.495 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.4 OUTLIER -96.76 138.38 34.41 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.753 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.6 mm -111.86 121.26 40.15 Favored Pre-proline 0 C--N 1.323 -0.565 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.311 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.64 130.34 18.09 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.05 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.468 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -100.77 127.1 54.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.188 0.518 . . . . 0.0 110.667 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.565 HG12 HG13 ' A' ' 13' ' ' VAL . 83.0 t -95.5 123.07 47.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.128 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.2 mt-10 -92.19 109.69 21.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.479 0.657 . . . . 0.0 110.514 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.565 HG13 HG12 ' A' ' 11' ' ' VAL . 3.5 m -126.22 -176.12 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.423 -176.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -91.27 -25.64 19.38 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.436 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.5 pt-20 -171.51 170.54 5.75 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.75 176.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.478 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.1 mm? -74.1 151.63 88.26 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.521 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -59.41 171.54 2.44 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.374 2.049 . . . . 0.0 111.81 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.74 130.67 42.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.044 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.86 -6.33 29.32 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.375 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.76 164.45 14.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.923 0.392 . . . . 0.0 111.363 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -115.83 97.36 6.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.363 -177.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.498 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 35.1 ttp85 . . . . . 0 C--N 1.322 -0.591 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.424 -175.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.405 ' CB ' ' HB2' ' B' ' 56' ' ' ALA . 23.8 tt0 . . . . . 0 N--CA 1.45 -0.467 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.529 ' HB2' HD21 ' B' ' 81' ' ' LEU . 77.4 m-85 -88.09 142.71 27.56 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.297 176.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -122.58 112.03 17.5 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.43 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 56.9 t -96.93 136.67 26.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.027 -171.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 9.0 mptt -132.52 132.62 42.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 174.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' MET . . . . . 0.565 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -113.57 138.82 49.61 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.473 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.542 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 9.8 tmtm? -143.49 136.63 27.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.948 0.404 . . . . 0.0 110.706 -176.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -100.95 135.94 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.825 -177.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' PHE . . . . . 0.542 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.6 m-85 -111.83 155.73 23.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.987 0.422 . . . . 0.0 110.709 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -127.21 119.25 25.97 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.968 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 63.41 46.98 91.4 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.415 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -126.57 171.04 11.44 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.58 -2.74 18.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.96 0.409 . . . . 0.0 111.101 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' TYR . . . . . 0.535 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.2 OUTLIER -150.06 128.15 11.95 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -84.49 -28.54 26.69 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.216 -173.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.638 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -133.59 135.78 44.49 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.65 -178.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -121.39 125.28 46.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.527 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' ILE . . . . . 0.638 HD11 HD12 ' B' ' 48' ' ' LEU . 1.8 mp -122.26 129.47 75.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.646 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -111.99 114.88 28.03 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.633 -178.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.18 104.53 14.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.459 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 14.9 pt-20 -108.41 153.08 23.8 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.339 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' ASN . . . . . 0.436 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -97.3 110.33 22.9 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.528 -179.343 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -137.32 91.59 2.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.086 0.47 . . . . 0.0 110.815 178.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' ALA . . . . . 0.405 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . . . . . . 0 C--N 1.321 -0.639 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.534 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 . . . . . 0 N--CA 1.449 -0.515 0 CA-C-O 120.805 0.336 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 10.9 m -135.33 78.97 50.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' PRO . . . . . 0.472 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.3 Cg_endo -77.19 149.18 27.95 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.312 2.008 . . . . 0.0 112.088 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.7 m -154.28 141.89 19.86 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.239 -179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.456 ' HB2' HD23 ' B' ' 75' ' ' LEU . 43.1 t80 -105.74 113.06 26.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.311 -178.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.2 p-10 -95.63 106.1 18.16 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 176.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -56.42 -34.07 66.42 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.335 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.72 -45.21 58.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.859 -176.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . 0.523 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.0 mt-10 -112.31 5.31 18.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.096 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . 0.452 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.6 p-10 48.86 42.31 19.99 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.755 1.284 . . . . 0.0 111.6 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.523 HG13 ' O ' ' B' ' 72' ' ' GLU . 65.7 mt -118.75 135.77 58.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.168 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.456 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -103.67 102.99 12.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.472 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -89.75 141.47 28.59 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -178.737 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 43.2 mm -97.97 -45.75 12.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.863 -176.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.406 ' OD1' ' HG2' ' B' ' 80' ' ' LYS . 3.3 t-20 -156.53 176.48 12.65 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.013 -172.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.14 2.4 44.02 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' LYS . . . . . 0.406 ' HG2' ' OD1' ' B' ' 78' ' ' ASN . 44.1 mmtm -89.22 -43.94 10.63 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' LEU . . . . . 0.529 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -157.0 153.46 28.03 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.495 0.664 . . . . 0.0 112.495 -176.258 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 15.8 p -124.28 146.91 48.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.812 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -108.18 102.35 45.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 120.888 0.375 . . . . 0.0 110.774 -177.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.46 ' HA ' HG12 ' B' ' 74' ' ' ILE . 60.5 Cg_endo -75.81 126.09 9.22 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.213 1.942 . . . . 0.0 112.127 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 83.5 mt -92.63 154.92 42.38 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.465 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' PRO . . . . . 0.436 ' HG2' HD12 ' B' ' 89' ' ' ILE . 39.3 Cg_endo -68.53 138.49 42.15 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 111.877 176.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' ARG . . . . . 0.452 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.1 mpt_? -80.69 -0.2 37.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -87.68 -10.35 51.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.386 0.612 . . . . 0.0 110.362 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' ILE . . . . . 0.516 ' CD1' HD23 ' B' ' 48' ' ' LEU . 57.4 mt -112.47 137.77 44.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.196 -175.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 64.6 t -83.19 111.73 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.917 177.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 92.7 t -118.69 131.32 71.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.597 0.713 . . . . 0.0 111.652 -174.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.35 159.89 41.34 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.228 176.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 93' ' ' ALA . . . . . 0.515 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -64.64 -14.79 59.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.12 0.486 . . . . 0.0 111.55 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.12 -26.19 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.077 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.38 -26.27 14.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.991 0.424 . . . . 0.0 110.582 -178.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 89.6 mt -69.0 113.4 4.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.764 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -110.41 108.15 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.875 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 98' ' ' ILE . . . . . 0.468 HG22 HG23 ' A' ' 10' ' ' VAL . 50.7 mt -111.92 116.39 52.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.85 0.357 . . . . 0.0 110.861 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 99' ' ' PHE . . . . . 0.409 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.3 m-85 -128.62 119.09 24.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.471 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 100' ' ' HIS . . . . . 0.475 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 13.1 t-80 -98.07 110.21 22.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.575 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 101' ' ' ILE . . . . . 0.636 HG22 ' H ' ' B' ' 104' ' ' GLU . 61.1 mt -91.28 104.57 15.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.649 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' B' ' 100' ' ' HIS . 20.7 mtm180 -76.12 -28.24 57.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.895 -177.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -59.9 -42.16 93.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.798 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.636 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.0 tp10 -99.05 -0.93 40.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.174 -177.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 58.61 30.24 19.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.788 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 106' ' ' THR . . . . . 0.4 HG23 ' HB3' ' B' ' 53' ' ' GLU . 28.0 m -127.99 139.22 52.69 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.016 0.436 . . . . 0.0 111.155 -172.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.8 tp -109.05 120.23 41.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.296 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 108' ' ' TYR . . . . . 0.646 ' CE2' HD11 ' B' ' 51' ' ' LEU . 31.5 m-85 -102.08 127.0 49.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 109' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 32.6 mm -113.87 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.798 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 110' ' ' TYR . . . . . 0.489 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.0 m-85 -122.32 126.5 48.22 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 111' ' ' ILE . . . . . 0.535 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 55.4 mt . . . . . 0 C--O 1.245 0.865 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.309 -177.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.12 70.44 7.12 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 123.188 2.592 . . . . 0.0 111.873 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -79.92 72.29 6.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.348 0.594 . . . . 0.0 110.71 -177.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 50.0 ttm -122.96 126.74 47.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.929 175.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 1.5 m -140.67 132.76 27.9 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.563 179.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' B' ' 93' ' ' ALA . 17.5 m -119.57 143.1 32.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 120.829 0.347 . . . . 0.0 110.795 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.41 137.4 33.41 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.4 mm -105.41 121.05 47.49 Favored Pre-proline 0 C--N 1.319 -0.747 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.101 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.86 125.71 12.96 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.196 1.931 . . . . 0.0 111.956 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.492 HG23 HG22 ' B' ' 98' ' ' ILE . 2.2 p -103.31 127.98 56.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.551 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.566 HG12 HG13 ' A' ' 13' ' ' VAL . 44.2 t -95.04 125.17 47.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.816 178.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.455 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 35.3 mt-10 -93.25 96.05 9.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.637 0.732 . . . . 0.0 110.428 178.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.593 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 5.0 m -107.27 177.49 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.208 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -95.09 -14.02 24.61 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.401 ' HA ' HG12 ' B' ' 101' ' ' ILE . 12.9 pt-20 -178.61 166.83 1.77 Allowed 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 114.596 -1.183 . . . . 0.0 109.677 173.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.1 mm? -73.73 149.6 88.21 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.532 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.03 168.18 21.35 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.432 2.088 . . . . 0.0 111.516 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.23 140.22 57.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -24.31 18.57 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.688 -176.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -86.06 164.32 17.4 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.016 0.436 . . . . 0.0 111.087 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.59 95.49 5.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.645 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.524 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.4 ttt-85 -101.18 147.38 26.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.0 178.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 m . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.651 -0.69 . . . . 0.0 109.656 179.857 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.478 0.602 0 N-CA-C 110.623 -0.568 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -127.73 -44.74 1.49 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.833 0.349 . . . . 0.0 110.636 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -144.11 34.02 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.134 0.492 . . . . 0.0 110.765 -177.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 20.6 mp0 -97.45 145.93 25.71 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.587 177.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -132.2 153.65 50.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.482 0.658 . . . . 0.0 111.551 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -129.83 -12.01 4.29 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.787 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -80.95 -10.56 59.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.486 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 98.3 t -68.05 122.29 83.37 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.201 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -69.89 130.03 18.48 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.599 2.199 . . . . 0.0 112.083 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -113.41 99.05 7.48 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.126 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.468 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 83.5 m-85 -89.86 152.82 21.07 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.731 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -129.65 119.05 22.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 177.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 51.9 t -97.48 132.12 42.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.533 -175.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -125.88 132.91 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 176.187 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.649 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.7 ttt -118.14 139.34 51.4 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.505 -175.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.509 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.3 tmtp? -144.9 132.73 21.19 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.309 -175.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.468 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -94.3 134.12 37.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.265 -176.55 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.509 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.9 m-85 -121.55 134.98 55.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.804 179.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -116.22 118.82 33.85 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.499 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 83.21 19.76 62.0 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.386 175.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -108.62 172.07 7.06 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 122.709 -0.289 . . . . 0.0 110.492 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.82 -20.37 63.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.343 0.592 . . . . 0.0 110.434 176.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.613 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -128.87 141.57 51.24 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.561 177.73 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -98.05 -21.45 16.79 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.229 0.537 . . . . 0.0 109.622 -176.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.649 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.09 132.83 29.02 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.235 -179.176 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 31.9 ttp180 -114.71 121.23 42.72 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.554 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.4 mp -118.52 128.54 75.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.549 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.3 mm? -114.98 121.09 42.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.442 -177.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -125.31 104.25 13.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.5 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.8 pt-20 -107.06 153.36 22.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.982 0.42 . . . . 0.0 110.614 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.14 107.41 19.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.129 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -130.05 93.78 3.57 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.458 0.647 . . . . 0.0 110.346 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.531 ' HB1' ' HD2' ' B' ' 57' ' ' PRO . . . -137.29 167.32 21.29 Favored Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.505 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.614 ' C ' HD22 ' B' ' 58' ' ' ASN . 9.8 Cg_endo -52.3 -49.66 16.65 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.089 1.86 . . . . 0.0 110.703 176.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . 0.614 HD22 ' C ' ' B' ' 57' ' ' PRO . 1.0 OUTLIER -126.16 -75.62 0.59 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.623 177.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.505 ' HB2' ' HB3' ' B' ' 56' ' ' ALA . 38.9 t 68.45 138.56 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.348 -176.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' B' ' 60' ' ' LYS . 13.9 ptmm? -129.95 74.94 80.15 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.695 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -69.7 141.87 46.65 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 121.954 1.769 . . . . 0.0 111.341 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -108.56 -69.78 0.84 Allowed 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.133 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.516 ' H ' ' HD2' ' B' ' 63' ' ' ARG . 0.0 OUTLIER -127.16 166.22 18.1 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 121.083 0.468 . . . . 0.0 110.898 -177.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -127.08 111.1 13.64 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.418 173.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 16.0 m -129.95 79.89 72.25 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-O 121.153 0.502 . . . . 0.0 109.778 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.442 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 63.9 Cg_endo -79.68 150.41 21.49 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.583 2.189 . . . . 0.0 111.784 178.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . 0.506 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 14.1 m -154.03 142.38 20.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.491 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.415 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 59.7 t80 -104.56 118.47 36.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.493 -178.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.475 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.0 OUTLIER -100.05 115.27 29.35 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.748 177.119 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -64.25 -28.2 69.57 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.506 -177.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.75 -46.63 70.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.407 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.499 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -112.46 2.44 16.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.568 -177.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . 0.444 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.1 p-10 48.37 45.56 20.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.38 1.072 . . . . 0.0 111.822 -175.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.499 HG13 ' O ' ' B' ' 72' ' ' GLU . 66.9 mt -124.07 137.95 55.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.152 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.412 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -102.9 104.21 14.43 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.5 p90 -93.07 142.1 27.67 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.222 -0.591 . . . . 0.0 109.84 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.1 mm -88.24 -54.02 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.391 -177.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 41.3 m-20 -153.25 176.91 11.43 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.3 40.63 1.75 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.56 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . 0.639 ' HD3' ' O ' ' B' ' 80' ' ' LYS . 0.0 OUTLIER -131.23 -36.53 1.3 Allowed 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.281 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.517 ' HG ' ' HG3' ' B' ' 80' ' ' LYS . 0.2 OUTLIER -154.53 153.53 31.61 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.441 0.638 . . . . 0.0 111.704 175.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 21.2 p -130.47 148.99 52.34 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.274 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 51.6 mm -107.84 102.53 45.79 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 120.819 0.342 . . . . 0.0 110.178 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.85 135.13 17.2 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.208 1.939 . . . . 0.0 112.117 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -97.59 141.09 22.47 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.559 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -64.76 139.62 63.77 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.986 1.791 . . . . 0.0 110.761 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.444 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.6 mpt_? -70.82 -0.99 10.2 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.789 -174.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -79.28 -16.79 55.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.534 0.683 . . . . 0.0 109.714 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -110.04 137.1 43.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.6 p -92.32 112.37 25.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . 0.415 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.5 p -121.38 139.32 48.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.306 0.574 . . . . 0.0 111.218 -174.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.582 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.5 164.69 29.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.011 -178.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.451 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -59.83 -23.53 63.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.058 0.456 . . . . 0.0 111.577 -176.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.06 -16.48 43.63 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.279 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.582 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.7 t70 -102.51 -24.27 13.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.683 0.754 . . . . 0.0 109.563 -176.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.442 HG22 HG13 ' B' ' 98' ' ' ILE . 81.3 mt -72.78 115.55 13.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.678 -1.146 . . . . 0.0 111.306 177.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.461 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -109.47 106.49 16.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.718 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.492 HG22 HG23 ' A' ' 10' ' ' VAL . 57.2 mt -110.99 121.14 63.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.447 -177.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -134.54 124.43 25.5 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.367 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.455 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 22.5 t-80 -105.5 113.09 26.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.715 -179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.593 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 3.0 mp -89.37 118.39 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 175.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 62.8 mtp85 -81.76 -23.71 36.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.866 -177.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -57.94 -43.33 86.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.14 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.512 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.0 pt-20 -110.0 0.98 18.72 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.456 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 58.27 38.49 26.08 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.63 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.5 HG23 ' HB3' ' B' ' 53' ' ' GLU . 29.1 m -117.73 137.92 52.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 120.921 0.391 . . . . 0.0 110.674 -176.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.25 114.35 28.43 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.875 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.549 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.2 m-85 -93.48 125.44 38.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.377 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.542 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 44.0 mm -115.04 121.95 68.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.109 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.461 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.0 m-85 -121.8 127.83 51.02 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.613 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.3 mt . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.783 -0.627 . . . . 0.0 109.767 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.419 ' HD2' ' HB1' ' B' ' 71' ' ' ALA . 94.6 Cg_endo -77.05 56.07 5.26 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.01 2.473 . . . . 0.0 113.126 -177.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.467 ' O ' ' HB3' ' A' ' 4' ' ' MET . 3.4 t-160 -162.65 -78.09 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 176.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.467 ' HB3' ' O ' ' A' ' 3' ' ' HIS . 22.3 ptp 172.0 158.35 0.09 Allowed 'General case' 0 C--O 1.234 0.278 0 O-C-N 123.748 0.655 . . . . 0.0 109.325 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.0 p -136.37 128.1 29.04 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.701 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.496 HG21 ' HB2' ' B' ' 93' ' ' ALA . 20.3 m -122.51 141.01 44.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.748 -176.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.434 ' HA ' ' CB ' ' B' ' 67' ' ' SER . 0.3 OUTLIER -88.19 138.03 31.81 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.061 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.572 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.0 mm -107.59 120.92 45.87 Favored Pre-proline 0 C--N 1.317 -0.827 0 C-N-CA 120.634 -0.427 . . . . 0.0 109.887 -176.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.12 130.63 21.84 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.503 2.135 . . . . 0.0 112.469 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.9 t -89.67 131.84 35.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.645 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.444 ' HB ' ' CD2' ' B' ' 99' ' ' PHE . 47.6 t -97.48 111.22 26.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 172.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.493 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.5 mt-10 -92.64 107.19 19.02 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.629 0.728 . . . . 0.0 110.789 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.4 m -135.43 -174.33 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-N 114.663 -1.153 . . . . 0.0 110.299 -177.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.523 ' OD1' ' HB2' ' B' ' 103' ' ' LYS . 24.5 m-20 -105.61 -10.07 17.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.887 0.375 . . . . 0.0 110.547 178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -165.19 156.28 14.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.687 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.481 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -84.77 156.2 61.45 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.702 0.287 . . . . 0.0 110.722 -179.1 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -54.88 170.55 0.61 Allowed 'Trans proline' 0 C--O 1.238 0.501 0 C-N-CA 123.464 2.776 . . . . 0.0 113.161 172.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -64.24 142.22 58.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.397 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.56 -9.7 66.7 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.24 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -88.11 147.1 25.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.274 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -101.38 102.89 13.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.434 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.481 ' HD2' HD22 ' A' ' 16' ' ' LEU . 14.5 ttt180 -104.67 143.92 32.42 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.049 -172.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.1 m . . . . . 0 C--O 1.251 1.136 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.276 176.454 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.479 0.649 0 CA-C-O 120.776 0.24 . . . . 0.0 111.754 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -142.44 45.25 1.63 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -92.55 -153.27 0.34 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.688 -170.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -71.5 174.11 7.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.08 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -76.9 157.42 31.39 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.741 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -108.78 -11.78 15.0 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.018 -177.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.401 ' HB2' ' HB2' ' B' ' 60' ' ' LYS . 5.3 p-10 -82.76 -4.56 58.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.979 -179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 39.5 t -55.85 112.58 4.46 Favored Pre-proline 0 C--N 1.329 -0.306 0 O-C-N 123.878 0.736 . . . . 0.0 112.178 -171.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.68 130.04 8.55 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.839 2.359 . . . . 0.0 111.64 174.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.575 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.1 tt0 -88.58 95.13 10.12 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.381 0.61 . . . . 0.0 109.766 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.517 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.6 m-85 -84.28 154.48 22.95 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.529 176.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -123.59 113.7 19.04 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -95.45 131.43 42.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.984 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.55 142.95 51.24 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.567 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -124.26 140.64 52.77 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.015 -0.274 . . . . 0.0 110.582 -176.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.9 tmtp? -145.3 133.82 22.0 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.704 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.473 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.92 137.49 34.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.713 179.366 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -117.54 150.67 38.58 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -125.27 111.17 14.91 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.958 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.59 54.52 6.62 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.584 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -136.81 171.45 14.48 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 174.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.78 66.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.687 0.756 . . . . 0.0 110.206 177.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.692 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -124.84 135.56 53.03 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.903 -1.044 . . . . 0.0 108.923 -178.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.5 mppt? -96.07 -23.53 16.75 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.619 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -136.66 130.3 31.97 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.735 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -118.63 123.46 45.04 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.836 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.619 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -120.04 130.85 73.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.73 119.95 38.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -178.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -123.74 103.48 12.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.517 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -108.86 153.7 23.15 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.693 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.412 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -100.52 114.43 28.05 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.501 -178.866 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.56 ' HD3' ' O ' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -137.61 90.95 2.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.664 0.745 . . . . 0.0 111.318 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.575 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -137.65 153.27 74.0 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.63 177.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.525 ' HG2' ' ND2' ' B' ' 58' ' ' ASN . 37.4 Cg_endo -69.29 -3.84 12.51 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.859 2.373 . . . . 0.0 112.684 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . 0.525 ' ND2' ' HG2' ' B' ' 57' ' ' PRO . 0.2 OUTLIER -136.79 -81.55 0.38 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.635 179.164 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.549 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 11.3 p 50.87 113.22 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.615 1.166 . . . . 0.0 113.863 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.401 ' HB2' ' HB2' ' B' ' 30' ' ' ASP . 14.1 mmmm -120.11 74.59 21.25 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.113 179.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -66.69 145.49 75.78 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.71 2.273 . . . . 0.0 111.99 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -98.82 -61.86 1.31 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.019 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -164.48 172.81 12.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.827 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -117.12 116.2 26.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.727 0.298 . . . . 0.0 110.451 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 11.5 t -135.61 79.86 46.08 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.67 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 66.2 Cg_endo -87.9 160.43 7.47 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.068 2.512 . . . . 0.0 113.168 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . 0.434 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 38.8 p -161.96 144.44 11.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.731 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.419 ' HB2' HD23 ' B' ' 75' ' ' LEU . 57.2 t80 -103.47 119.58 39.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.787 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -100.58 116.06 31.63 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.503 175.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.413 ' CD1' ' HG3' ' A' ' 4' ' ' MET . 47.2 m-85 -66.98 -24.91 66.09 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.891 -176.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.419 ' HB1' ' HD2' ' A' ' 2' ' ' PRO . . . -58.01 -43.26 86.58 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.708 -178.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.457 ' O ' HG13 ' B' ' 74' ' ' ILE . 10.3 mt-10 -112.45 4.76 17.68 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . 0.412 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.4 p-10 48.24 43.14 18.67 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 124.524 1.14 . . . . 0.0 111.067 -176.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.457 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.5 mt -119.25 134.67 62.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.269 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.419 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.5 tm? -102.92 103.34 13.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 176.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.431 ' HB2' ' HB3' ' B' ' 82' ' ' SER . 0.0 OUTLIER -88.8 144.91 25.92 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -178.173 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . 0.421 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 42.5 mm -98.51 -57.45 4.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.155 0.502 . . . . 0.0 110.927 -177.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 16.2 m-20 -147.07 179.06 7.89 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.192 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.22 4.76 10.72 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.286 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -93.86 -45.1 7.79 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -151.8 153.23 33.85 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.557 0.694 . . . . 0.0 112.452 -177.464 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' B' ' 76' ' ' TYR . 10.6 p -126.47 147.43 49.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.891 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 52.1 mm -106.83 109.12 62.93 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.936 0.398 . . . . 0.0 110.751 -177.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.416 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.9 Cg_endo -81.49 137.15 10.18 Favored 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.262 1.974 . . . . 0.0 112.024 178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.91 150.18 36.83 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.949 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.463 ' HG2' HD12 ' B' ' 89' ' ' ILE . 28.6 Cg_endo -63.22 142.15 85.26 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.537 2.158 . . . . 0.0 111.552 176.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.412 ' NE ' HD21 ' B' ' 73' ' ' ASN . 10.0 mpt_? -79.19 -2.83 42.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.069 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -92.33 2.33 56.7 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.786 0.327 . . . . 0.0 111.083 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.463 HD12 ' HG2' ' B' ' 86' ' ' PRO . 58.1 mt -121.95 138.28 52.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.506 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.26 122.91 38.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 176.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 52.3 t -126.14 130.16 72.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.207 0.527 . . . . 0.0 111.299 -174.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.618 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.31 161.44 37.89 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.725 177.427 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.496 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -65.45 -12.6 54.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.201 -175.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.62 -9.23 47.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.213 0.53 . . . . 0.0 110.882 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.618 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 12.7 t70 -111.75 -24.82 9.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.673 -178.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.3 mt -73.08 115.06 13.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.949 176.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.458 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.9 mmmm -111.35 101.92 10.35 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.949 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.572 HD12 ' HB ' ' A' ' 8' ' ' ILE . 32.8 mt -101.85 122.6 54.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-O 121.096 0.474 . . . . 0.0 111.343 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.444 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 70.7 m-85 -133.21 118.13 18.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.252 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.493 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 20.2 t-80 -100.4 107.78 19.62 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.821 0.343 . . . . 0.0 110.495 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.63 HD12 ' CE1' ' B' ' 108' ' ' TYR . 49.8 mt -86.85 102.56 12.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.18 0.514 . . . . 0.0 110.021 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -17.34 63.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.658 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . 0.523 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 30.8 tttm -67.19 -48.91 66.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.998 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.606 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.4 mm-40 -101.32 4.93 42.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.159 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? 55.28 37.08 28.36 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.652 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.439 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 40.0 m -125.25 130.6 52.39 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.066 -174.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.54 117.69 33.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.629 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.63 ' CE1' HD12 ' B' ' 101' ' ' ILE . 10.1 m-85 -95.99 124.39 39.98 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.113 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.571 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.1 mm -114.81 115.92 50.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.869 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.505 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.3 m-85 -116.4 125.11 51.58 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 176.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.692 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 58.7 mt . . . . . 0 C--O 1.246 0.908 0 CA-C-O 118.94 -0.552 . . . . 0.0 109.741 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.62 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.72 120.5 8.35 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 122.542 2.161 . . . . 0.0 111.279 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' B' ' 71' ' ' ALA . 65.8 m80 -77.8 65.75 3.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.719 0.771 . . . . 0.0 111.094 -175.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 59.5 ttp -133.43 136.34 45.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 114.784 -1.098 . . . . 0.0 108.877 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.3 m -134.65 144.22 47.72 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.438 HG21 ' HB2' ' B' ' 93' ' ' ALA . 19.7 m -130.81 145.89 34.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.941 0.4 . . . . 0.0 110.891 -177.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 136.15 33.14 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.899 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.459 ' HB ' HD12 ' B' ' 98' ' ' ILE . 6.5 mm -105.19 121.08 47.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.309 -178.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -73.03 130.53 15.58 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.433 2.089 . . . . 0.0 112.26 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.409 HG13 HG22 ' B' ' 98' ' ' ILE . 46.4 t -86.95 133.3 30.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.576 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.511 HG12 HG13 ' A' ' 13' ' ' VAL . 98.9 t -98.01 119.94 46.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 173.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.415 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 28.8 mt-10 -93.18 111.99 23.79 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.566 0.698 . . . . 0.0 110.697 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.511 HG13 HG12 ' A' ' 11' ' ' VAL . 4.8 m -129.6 170.46 18.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.535 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -91.61 -20.24 21.86 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -168.76 155.9 7.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.12 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.446 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -78.7 149.32 74.3 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -67.56 172.23 10.71 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.328 2.019 . . . . 0.0 111.44 177.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.74 135.86 57.01 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.163 0.506 . . . . 0.0 111.439 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.0 -17.26 27.31 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.793 -175.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -94.06 146.73 23.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.939 0.4 . . . . 0.0 111.074 178.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -101.27 95.22 6.38 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.103 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.446 ' HD2' HD22 ' A' ' 16' ' ' LEU . 18.3 ttt180 -90.84 146.48 23.9 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.841 -178.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.305 -0.855 . . . . 0.0 109.341 177.248 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.479 0.666 0 N-CA-C 110.547 -0.597 . . . . 0.0 110.547 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 42.4 m80 69.53 -52.91 0.61 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.578 0.751 . . . . 0.0 111.697 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -58.39 121.18 10.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.817 0.341 . . . . 0.0 110.568 178.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -131.17 147.35 52.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.683 176.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -82.71 155.0 24.54 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.149 0.5 . . . . 0.0 110.772 -177.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.436 ' H ' ' CD ' ' B' ' 29' ' ' GLU . 0.0 OUTLIER -103.14 -29.81 11.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.322 179.593 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -92.28 26.17 2.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.031 176.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.0 p -69.74 123.05 87.81 Favored Pre-proline 0 N--CA 1.448 -0.533 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.69 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.479 ' HA ' ' HB3' ' B' ' 59' ' ' SER . 20.0 Cg_endo -64.89 130.06 24.98 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.756 2.304 . . . . 0.0 112.598 -178.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.48 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 29.9 tt0 -104.03 102.85 12.61 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.541 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 92.5 m-85 -90.47 142.03 28.15 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.692 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.443 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 35.2 tt0 -112.4 107.15 15.84 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.57 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.6 p -94.91 127.26 47.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.261 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.443 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -124.26 121.44 35.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.572 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.5 ttt -107.65 139.11 42.7 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 -175.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.548 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 8.4 tmtm? -144.54 134.87 24.38 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.853 0.358 . . . . 0.0 110.515 -174.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.509 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -94.76 134.17 37.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -178.808 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.548 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 34.5 m-85 -119.15 139.4 51.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.985 0.422 . . . . 0.0 111.128 177.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -130.41 116.29 18.06 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.597 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 90.82 32.27 9.29 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.95 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -129.79 170.85 13.35 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.43 64.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.401 0.619 . . . . 0.0 110.448 177.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.566 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.3 p90 -126.97 147.58 50.11 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.795 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.509 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.9 mppt? -104.57 -18.62 14.27 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-O 121.24 0.543 . . . . 0.0 109.742 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.629 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.83 133.34 31.9 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.398 -179.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -119.77 131.12 55.26 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 174.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.629 HD11 HD12 ' B' ' 48' ' ' LEU . 1.9 mp -128.19 128.45 68.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.581 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.9 mm? -111.55 119.92 40.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.1 mp -126.88 104.07 12.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.541 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -111.43 153.76 25.65 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.942 0.401 . . . . 0.0 110.55 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.06 100.32 11.46 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.488 -179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.415 ' HD3' ' HB2' ' B' ' 35' ' ' GLU . 18.4 ptmt -129.28 93.5 3.58 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.6 -177.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.612 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -134.83 158.2 75.5 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.106 176.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -60.68 -41.63 45.51 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.492 2.128 . . . . 0.0 110.559 172.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 31.6 m-80 -138.56 97.43 3.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.073 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.612 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 11.9 p -134.32 134.3 41.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.512 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -128.13 77.28 76.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.887 177.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -67.75 144.88 67.26 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 122.421 2.081 . . . . 0.0 111.744 176.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -85.59 -63.85 1.25 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.19 -178.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -164.91 177.45 7.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.495 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . 0.404 ' CD1' HD12 ' B' ' 107' ' ' LEU . 72.9 m-85 -114.57 117.95 32.36 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.546 176.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.3 m -133.02 79.21 63.42 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 176.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -83.29 153.38 14.07 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.78 2.32 . . . . 0.0 112.436 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.2 m -156.65 145.95 20.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.213 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.448 ' HB2' HD23 ' B' ' 75' ' ' LEU . 49.8 t80 -108.34 124.42 50.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.599 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -105.28 116.71 32.41 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.646 176.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -66.7 -25.89 66.76 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.687 -176.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.429 ' HB2' ' HA ' ' A' ' 3' ' ' HIS . . . -54.8 -50.99 67.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.547 -178.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.9 mt-10 -112.68 7.56 18.71 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.486 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 50.66 42.73 27.51 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 124.268 0.98 . . . . 0.0 111.429 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 68.1 mt -117.75 138.07 49.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.457 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.448 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -105.03 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -93.49 140.17 29.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.7 mm -92.85 -57.06 4.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.958 -176.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' B' ' 80' ' ' LYS . 57.8 m-20 -151.95 -177.81 6.37 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -178.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.19 20.93 2.94 Favored Glycine 0 C--O 1.225 -0.409 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.964 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . 0.415 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.7 mmtt -110.62 -38.36 5.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.8 OUTLIER -160.47 153.36 21.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.876 178.052 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.2 t -127.92 150.37 49.91 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.584 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mm -114.81 100.81 53.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 120.952 0.405 . . . . 0.0 111.045 -175.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.408 ' HA ' HG12 ' B' ' 74' ' ' ILE . 21.4 Cg_exo -67.92 136.55 38.67 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.712 2.275 . . . . 0.0 112.33 177.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 63.6 mt -103.65 153.82 38.37 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.092 -178.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.447 ' HG2' HD12 ' B' ' 89' ' ' ILE . 46.4 Cg_endo -72.33 138.69 30.63 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.125 1.883 . . . . 0.0 111.787 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 1.8 mmt180 -74.9 2.18 10.95 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.804 -177.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -86.91 -18.41 30.88 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.415 0.626 . . . . 0.0 110.053 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.447 HD12 ' HG2' ' B' ' 86' ' ' PRO . 66.7 mt -104.38 134.01 46.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.303 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 48.3 t -82.46 111.57 19.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.85 130.93 73.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.324 0.583 . . . . 0.0 111.461 -172.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.576 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.82 163.36 33.11 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.358 175.137 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.438 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.21 -19.01 64.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.913 0.387 . . . . 0.0 111.799 -177.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.3 -13.3 55.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.961 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.576 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 23.3 t0 -109.04 -20.69 12.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.573 0.701 . . . . 0.0 109.881 -177.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.418 HG22 HG13 ' B' ' 98' ' ' ILE . 80.3 mt -76.73 116.27 19.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.786 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.5 mmmt -109.62 104.07 13.03 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.254 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.459 HD12 ' HB ' ' A' ' 8' ' ' ILE . 49.1 mt -107.82 121.38 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.015 0.436 . . . . 0.0 110.984 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -130.71 121.12 24.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.257 -178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.415 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 30.1 t-80 -104.5 114.76 29.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.898 0.38 . . . . 0.0 110.597 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.518 HG22 ' H ' ' B' ' 104' ' ' GLU . 58.7 mt -90.96 100.55 11.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 172.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -69.69 -24.48 63.59 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.148 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -59.23 -47.92 83.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.321 0.581 . . . . 0.0 110.494 176.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.518 ' H ' HG22 ' B' ' 101' ' ' ILE . 13.7 mm-40 -100.88 0.79 39.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.819 -175.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 67.6 mtp85 57.1 33.5 23.42 Favored 'General case' 0 N--CA 1.46 0.072 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.66 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.418 ' CG2' HD12 ' B' ' 51' ' ' LEU . 46.1 m -119.62 130.13 54.95 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.58 -174.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . 0.406 HD21 ' CG2' ' B' ' 98' ' ' ILE . 0.5 OUTLIER -102.27 121.27 41.94 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.03 178.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.581 ' CE2' HD11 ' B' ' 51' ' ' LEU . 17.7 m-85 -98.97 126.79 44.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.155 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.511 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.3 mm -115.36 121.4 67.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.899 175.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 82.2 m-85 -122.55 124.32 43.26 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 175.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.566 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.819 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.901 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.622 0 N-CA-C 112.178 -0.369 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -71.77 141.28 37.12 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.918 2.412 . . . . 0.0 111.523 178.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' B' ' 71' ' ' ALA . 2.2 p80 -102.13 54.61 0.8 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.397 0.618 . . . . 0.0 110.555 -177.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 54.9 tpp -55.65 124.68 18.18 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.088 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.3 p -147.46 135.37 21.23 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.406 -174.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.5 m -125.84 142.63 41.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.324 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.51 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -91.5 140.05 30.12 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.352 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.5 mm -110.35 123.52 35.67 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 -176.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -71.39 125.51 11.35 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.077 1.851 . . . . 0.0 111.979 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.486 HG23 HG22 ' B' ' 98' ' ' ILE . 1.9 p -97.65 119.96 46.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.122 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.559 HG12 HG13 ' A' ' 13' ' ' VAL . 61.5 t -91.29 117.13 33.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -84.72 111.91 20.01 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.325 0.583 . . . . 0.0 110.271 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.559 HG13 HG12 ' A' ' 11' ' ' VAL . 3.3 m -124.55 -174.77 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.58 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -93.73 -26.77 16.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -171.14 167.19 7.16 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.344 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.494 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.3 mm? -71.04 143.49 88.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.526 -0.307 . . . . 0.0 110.636 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.92 174.48 11.15 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.928 2.419 . . . . 0.0 112.259 176.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.85 139.77 12.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.459 178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.16 -9.42 57.85 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.429 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -102.86 167.52 9.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.991 0.424 . . . . 0.0 111.953 -179.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -127.53 98.92 5.39 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.575 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' HB2' HD23 ' A' ' 16' ' ' LEU . 26.5 ttp85 -93.92 140.1 30.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.4 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.2 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.76 -0.638 . . . . 0.0 110.082 -177.024 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo . . . . . 0 N--CA 1.471 0.178 0 N-CA-C 111.29 -0.311 . . . . 0.0 111.29 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -122.93 71.53 1.05 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.0 0.429 . . . . 0.0 110.534 177.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -140.34 147.61 40.09 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.893 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -77.91 145.43 36.16 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -142.11 162.43 35.5 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.327 0.584 . . . . 0.0 111.971 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -120.14 -15.32 8.72 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.781 -1.1 . . . . 0.0 109.977 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -86.11 -3.87 59.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.06 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 4.4 p -65.22 117.64 41.98 Favored Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.045 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -65.73 130.2 24.17 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.418 2.079 . . . . 0.0 112.061 -177.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.539 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.8 tt0 -97.18 100.02 11.5 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.255 0.55 . . . . 0.0 109.573 178.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 79.1 m-85 -85.76 145.16 27.37 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.029 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -123.47 112.75 17.88 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.634 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.2 p -100.83 131.39 48.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.694 -174.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -120.81 150.51 40.91 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.581 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.3 ttt -135.63 134.49 39.31 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -176.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 10.2 tmtt? -142.83 132.55 23.94 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.996 -0.281 . . . . 0.0 110.527 -172.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.477 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.5 OUTLIER -95.01 133.01 39.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.132 0.492 . . . . 0.0 111.006 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.407 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 14.3 m-85 -111.85 140.33 46.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.012 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -118.4 121.97 41.64 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.275 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.01 46.54 43.63 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.638 -179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.09 170.94 14.26 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.49 -14.41 62.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.106 0.479 . . . . 0.0 110.768 178.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -134.82 137.69 43.56 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.611 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.531 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 3.0 mppt? -96.32 -23.2 16.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.519 . . . . 0.0 109.841 -173.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.581 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.35 133.51 34.96 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.448 -176.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -119.31 122.46 41.92 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.569 ' CD1' HD12 ' B' ' 48' ' ' LEU . 2.4 mp -117.4 131.56 69.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.634 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 3.4 mm? -117.52 118.03 31.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.628 -176.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -122.71 103.74 13.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.9 pt-20 -110.42 153.41 25.03 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.371 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.42 ' OD1' ' HB3' ' B' ' 59' ' ' SER . 1.7 t-20 -102.12 108.82 20.36 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.365 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 ptmm? -134.01 92.84 3.01 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.651 -178.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.539 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.71 160.93 64.59 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.663 175.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.418 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 17.8 Cg_endo -56.07 -44.57 45.61 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.698 2.265 . . . . 0.0 110.839 175.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -134.35 88.61 2.47 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.033 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.51 ' C ' ' HD2' ' B' ' 60' ' ' LYS . 4.2 m -95.5 111.58 23.46 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.749 -174.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.51 ' HD2' ' C ' ' B' ' 59' ' ' SER . 0.7 OUTLIER -122.13 75.7 40.75 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.503 178.212 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.56 151.65 47.49 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.011 2.474 . . . . 0.0 111.704 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -84.5 -52.62 6.01 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.025 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 18.3 ptt180 -169.55 -178.76 3.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.832 -177.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -127.31 108.03 10.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.975 170.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 50.6 m -138.3 79.97 29.43 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.449 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 71.9 Cg_endo -81.38 153.31 18.25 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.634 2.223 . . . . 0.0 113.102 -178.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . 0.508 ' CB ' ' HA ' ' A' ' 7' ' ' GLN . 99.2 p -159.09 150.38 20.27 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.206 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.471 ' HB2' HD23 ' B' ' 75' ' ' LEU . 45.0 t80 -108.83 128.01 54.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.597 -177.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.568 ' O ' ' HA ' ' B' ' 73' ' ' ASN . 0.1 OUTLIER -108.2 128.11 54.43 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 176.512 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -75.1 -25.41 58.51 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.297 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.429 ' HB2' ' HA ' ' A' ' 3' ' ' HIS . . . -60.79 -51.45 69.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.816 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.52 ' O ' HD13 ' B' ' 74' ' ' ILE . 11.0 mm-40 -103.62 -10.6 18.28 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . 0.568 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 1.8 p-10 59.95 45.34 12.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.499 1.143 . . . . 0.0 110.183 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.52 HD13 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.7 143.8 17.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 113.914 -1.494 . . . . 0.0 109.099 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.471 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.2 tm? -110.27 97.83 7.21 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.1 OUTLIER -87.42 143.69 27.11 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -177.037 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 45.3 mm -95.84 -56.08 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.417 -171.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -160.46 24.0 0.15 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 -174.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.1 -22.94 5.58 Favored Glycine 0 C--N 1.322 -0.246 0 C-N-CA 120.122 -1.037 . . . . 0.0 112.774 176.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -79.48 -28.61 41.48 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.451 HD21 ' CB ' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -162.45 153.54 17.63 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.325 175.031 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 63.5 p -124.3 150.61 45.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.571 175.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -106.93 100.14 30.15 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.809 0.338 . . . . 0.0 110.328 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.519 ' HA ' HD12 ' B' ' 74' ' ' ILE . 25.9 Cg_exo -65.91 131.5 27.44 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.686 2.257 . . . . 0.0 112.005 177.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 87.6 mt -101.72 151.37 37.89 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.261 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.35 143.24 31.15 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.647 2.231 . . . . 0.0 112.206 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -3.38 49.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.5 -178.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -82.44 -9.62 59.36 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.012 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 59.9 mt -118.88 136.49 55.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.429 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.7 p -87.55 115.11 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 48.1 t -123.06 136.18 60.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.095 0.474 . . . . 0.0 111.248 -174.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.747 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.48 164.54 29.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.965 178.396 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.16 -23.83 65.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.652 -176.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.67 -12.03 56.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.769 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.747 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 14.4 t0 -104.06 -24.64 13.19 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.787 0.803 . . . . 0.0 109.244 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.36 117.69 24.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.219 -179.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.6 mmmt -112.09 108.0 17.12 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.985 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.486 HG22 HG23 ' A' ' 10' ' ' VAL . 47.2 mt -111.63 118.26 57.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.891 0.377 . . . . 0.0 111.113 -178.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -132.45 121.83 24.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.269 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.516 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 38.4 t-80 -107.02 112.09 24.87 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.958 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.597 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.9 mp -85.18 108.35 16.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 7.4 ptp180 -76.12 -24.9 54.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.119 -174.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -61.5 -46.5 89.73 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.037 0.446 . . . . 0.0 110.488 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.597 ' H ' HG22 ' B' ' 101' ' ' ILE . 14.6 mt-10 -92.12 -2.2 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.28 0.562 . . . . 0.0 110.096 179.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 47.6 mtp180 54.23 38.91 30.21 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.287 -177.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.471 HG23 ' HB3' ' B' ' 53' ' ' GLU . 32.8 m -123.34 131.95 53.83 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.82 -172.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.73 114.89 29.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.454 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.616 ' CE2' HD11 ' B' ' 51' ' ' LEU . 48.6 m-85 -93.67 120.87 34.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.05 177.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.544 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 34.4 mm -110.88 123.85 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.974 177.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.443 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 84.7 m-85 -122.69 129.12 51.45 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 63.8 mt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.738 -0.649 . . . . 0.0 109.618 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.637 0 N-CA-C 112.173 -0.371 . . . . 0.0 112.173 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -63.47 -22.75 71.2 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.872 2.381 . . . . 0.0 113.077 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -96.34 83.33 3.54 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 44.8 ttm -57.72 125.6 23.69 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 177.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 27.2 p -149.36 148.56 29.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.343 0.592 . . . . 0.0 112.316 -174.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.2 m -128.75 142.54 43.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.549 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.413 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -86.11 137.81 32.39 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 -177.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 mm -109.04 118.66 50.84 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -70.71 123.89 10.19 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.122 1.881 . . . . 0.0 111.849 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.5 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -96.14 127.92 47.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.773 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.514 HG12 HG13 ' A' ' 13' ' ' VAL . 58.6 t -92.12 128.21 43.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.71 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.436 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 39.5 mt-10 -97.49 109.11 21.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.328 0.585 . . . . 0.0 110.322 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 4.5 m -131.76 176.14 9.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.553 -177.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -101.2 -9.73 21.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.652 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -164.3 156.38 16.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.926 176.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.489 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -83.78 153.7 64.37 Favored Pre-proline 0 N--CA 1.446 -0.641 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.12 177.336 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -51.89 167.07 0.5 Allowed 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.38 2.72 . . . . 0.0 113.318 173.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -72.3 130.54 41.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.99 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.6 29.91 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -173.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -98.28 153.05 18.79 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.071 0.462 . . . . 0.0 110.762 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -110.25 97.75 7.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.872 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.559 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 53.1 ttp85 -97.43 144.84 26.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.071 0.462 . . . . 0.0 111.683 -176.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.7 p . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.322 -0.854 . . . . 0.0 108.754 174.482 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo . . . . . 0 N--CA 1.475 0.433 0 N-CA-C 110.342 -0.676 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 55.2 48.97 18.28 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.822 0.82 . . . . 0.0 110.039 -175.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.95 27.81 4.22 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.601 -1.181 . . . . 0.0 109.629 -177.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -110.62 148.8 31.46 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.087 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -102.01 167.45 10.03 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.367 0.604 . . . . 0.0 111.012 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -95.35 -5.75 42.66 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.751 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.674 ' HA ' ' O ' ' B' ' 58' ' ' ASN . 9.9 m-20 -82.91 -14.06 54.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.643 175.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 95.0 t -60.33 116.57 18.32 Favored Pre-proline 0 N--CA 1.451 -0.401 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.153 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.52 129.06 24.0 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.395 2.064 . . . . 0.0 112.242 -176.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.551 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.0 tt0 -106.76 99.51 9.07 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.126 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 90.4 m-85 -86.89 152.66 22.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.478 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -120.53 110.58 16.63 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.009 176.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 57.3 t -92.96 124.21 45.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.397 -178.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -121.57 137.92 54.53 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.107 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.526 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -120.43 139.83 52.26 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 -175.748 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.517 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.2 135.72 21.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.678 0.275 . . . . 0.0 110.295 -176.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.517 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -97.66 135.48 39.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.885 0.374 . . . . 0.0 111.167 -178.128 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -118.26 147.53 43.34 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.458 177.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -133.72 119.8 19.76 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.065 0.459 . . . . 0.0 110.494 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.85 26.97 52.19 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.109 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.79 171.25 8.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.91 -13.98 60.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.133 0.492 . . . . 0.0 110.98 179.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.572 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -133.09 146.33 51.55 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 176.537 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.52 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 3.0 mppt? -100.95 -22.26 14.84 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.23 0.538 . . . . 0.0 109.726 -177.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.562 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.94 135.42 36.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.225 -178.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -120.46 129.16 53.75 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -123.16 131.65 72.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.63 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -115.14 117.13 29.67 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.2 102.9 13.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.493 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.9 pt-20 -109.05 153.32 23.81 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.896 0.379 . . . . 0.0 110.168 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.62 113.85 26.07 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.91 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.404 ' NZ ' ' HB2' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.02 93.23 3.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.368 0.604 . . . . 0.0 110.562 178.066 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.551 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -137.27 163.23 50.44 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.757 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 14.0 Cg_endo -57.12 -44.52 43.16 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.036 1.824 . . . . 0.0 111.416 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . 0.674 ' O ' ' HA ' ' B' ' 30' ' ' ASP . 29.0 m-80 -137.74 68.22 1.41 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.888 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 12.0 p -61.53 115.46 3.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.433 0.635 . . . . 0.0 111.556 -175.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.41 ' HA ' ' HE3' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -126.15 73.01 71.71 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.782 177.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -70.99 147.18 54.39 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.357 2.038 . . . . 0.0 111.395 176.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -86.86 -54.16 4.51 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.839 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -166.92 175.98 7.31 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.597 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -125.49 111.37 14.99 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.473 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.0 t -131.96 78.17 70.22 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.536 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 81.6 Cg_endo -81.1 151.39 18.2 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.766 2.31 . . . . 0.0 113.621 -178.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 15.2 m -156.08 150.53 25.76 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.035 176.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.479 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 40.1 t80 -108.02 124.35 50.04 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.714 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.551 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.8 p-10 -103.3 112.36 25.2 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.109 0.481 . . . . 0.0 110.55 176.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.61 -33.01 73.16 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.575 -177.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.64 -48.92 68.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.623 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.56 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.4 mt-10 -110.54 5.93 21.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.411 -176.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 48.51 43.16 19.82 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.397 1.06 . . . . 0.0 111.587 -178.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.56 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.2 mt -118.15 143.32 29.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.555 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.426 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -109.32 101.81 10.77 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.536 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -88.6 142.81 27.39 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.826 -178.086 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 47.5 mm -96.05 -48.92 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.576 -177.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -165.71 -168.18 1.26 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.584 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.75 -4.94 59.7 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.007 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -86.5 -40.12 15.59 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.454 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.9 OUTLIER -161.6 154.02 20.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.602 0.715 . . . . 0.0 112.675 -179.762 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.9 p -123.58 148.25 46.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.415 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.6 mm -105.23 105.21 51.06 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 120.621 0.248 . . . . 0.0 110.536 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.477 ' HA ' HG12 ' B' ' 74' ' ' ILE . 59.1 Cg_endo -74.85 131.58 14.64 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.138 1.892 . . . . 0.0 111.77 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 65.9 mt -99.79 154.08 37.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.031 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -68.43 139.91 46.57 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.335 2.023 . . . . 0.0 112.061 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.403 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 9.7 mpt_? -77.59 -6.85 55.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.612 -177.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -84.76 -12.43 53.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.302 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.6 mt -113.96 133.83 58.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.986 -176.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -84.5 127.78 39.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.481 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . 0.479 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -137.35 138.91 44.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.259 0.552 . . . . 0.0 111.524 -174.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.558 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.33 166.38 24.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.044 178.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.09 -22.57 64.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.147 0.499 . . . . 0.0 111.572 -177.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.81 -9.75 55.09 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.114 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.558 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 31.0 t70 -107.08 -23.76 12.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.755 0.788 . . . . 0.0 109.688 -178.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.407 HG22 HG13 ' B' ' 98' ' ' ILE . 76.9 mt -74.74 116.69 17.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 114.686 -1.143 . . . . 0.0 111.443 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.4 mmmm -111.34 105.36 13.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.894 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.5 HG22 HG23 ' A' ' 10' ' ' VAL . 56.3 mt -110.17 120.55 61.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.994 -178.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -131.23 119.2 21.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.02 0.438 . . . . 0.0 110.798 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.436 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.4 t-80 -97.14 108.03 20.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.675 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.555 ' HA ' ' O ' ' A' ' 13' ' ' VAL . 46.8 mt -86.7 98.01 6.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 172.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -72.99 -20.59 60.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.91 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -58.15 -49.09 78.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.472 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.474 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.4 mm-40 -99.88 1.14 42.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.538 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 55.02 36.13 26.25 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.269 -175.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.493 HG23 ' HB3' ' B' ' 53' ' ' GLU . 22.7 m -116.73 126.4 53.1 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.35 -176.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 54.3 tp -101.28 121.72 42.38 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.662 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.63 ' CE2' HD11 ' B' ' 51' ' ' LEU . 21.2 m-85 -101.97 128.29 48.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.384 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.6 mm -116.3 122.0 68.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.66 175.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.49 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 86.0 m-85 -122.44 126.35 47.74 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.572 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--N 1.319 -0.752 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.715 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.677 0 N-CA-C 111.812 -0.515 . . . . 0.0 111.812 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.06 164.41 22.37 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.839 2.36 . . . . 0.0 112.208 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -124.53 63.28 1.11 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.331 0.586 . . . . 0.0 109.566 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 83.0 mtp -81.96 137.41 35.15 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.798 -176.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 28.5 p -158.68 127.13 5.31 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.736 -1.12 . . . . 0.0 110.014 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.4 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.3 m -124.22 140.73 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.068 0.461 . . . . 0.0 110.642 -178.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 135.1 35.03 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.157 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.4 mm -112.07 114.18 51.47 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -71.5 135.81 27.19 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 121.869 1.712 . . . . 0.0 111.08 175.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.496 HG23 HG22 ' B' ' 98' ' ' ILE . 1.4 p -100.41 128.59 52.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.748 -177.343 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.506 HG12 HG13 ' A' ' 13' ' ' VAL . 47.6 t -87.26 112.68 23.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.766 179.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.7 mt-10 -92.13 106.76 18.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.444 0.64 . . . . 0.0 110.223 179.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.506 HG13 HG12 ' A' ' 11' ' ' VAL . 2.2 m -129.21 -172.57 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.01 -0.995 . . . . 0.0 111.084 -175.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -96.87 -30.22 13.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.143 0.497 . . . . 0.0 109.661 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -149.66 166.05 30.51 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.233 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.8 mm? -80.05 141.47 54.5 Favored Pre-proline 0 C--N 1.316 -0.874 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.198 173.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.71 166.47 0.23 Allowed 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 123.485 2.79 . . . . 0.0 113.029 172.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -68.56 132.34 46.77 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.578 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.1 -2.17 29.91 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.711 -0.757 . . . . 0.0 111.638 -174.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -102.46 175.18 5.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.996 0.427 . . . . 0.0 111.142 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -131.59 112.33 12.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.707 178.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.494 ' HB2' HD23 ' A' ' 16' ' ' LEU . 33.5 ttp85 -118.75 147.75 43.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.53 178.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.3 m . . . . . 0 C--O 1.244 0.792 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.869 179.48 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo . . . . . 0 N--CA 1.473 0.291 0 N-CA-C 110.422 -0.645 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -89.63 80.52 6.62 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.4 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 60.29 -160.69 0.29 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.636 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -72.86 177.0 5.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.434 0.635 . . . . 0.0 111.227 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . 0.416 ' HB2' HG23 ' B' ' 31' ' ' VAL . 54.4 mt-30 -110.42 159.15 17.74 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.766 -178.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -75.81 -15.19 60.28 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.317 -175.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -88.37 -4.03 58.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.533 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' B' ' 28' ' ' GLN . 49.0 t -79.59 114.1 42.76 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.721 -178.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -72.33 133.98 21.94 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 122.639 2.226 . . . . 0.0 112.257 177.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -108.21 100.07 9.42 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.453 ' HB2' HD21 ' B' ' 81' ' ' LEU . 96.1 m-85 -90.5 154.92 19.27 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.372 -178.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -120.0 108.9 14.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.068 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 92.1 t -91.11 129.36 41.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.008 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.434 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -127.07 142.75 51.45 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 176.791 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.559 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.3 ttt -123.97 141.21 52.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.964 -0.294 . . . . 0.0 110.637 -175.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.9 tmtt? -140.92 133.47 28.57 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.562 -176.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.46 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 9.2 mpt_? -99.34 138.73 36.01 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.995 0.426 . . . . 0.0 111.059 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.404 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 53.8 m-85 -118.77 167.32 11.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.448 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.31 105.23 4.02 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.013 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.84 46.96 6.9 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.656 -0.783 . . . . 0.0 111.891 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.98 172.19 12.96 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.5 -25.27 64.32 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.554 0.692 . . . . 0.0 110.492 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.571 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.6 OUTLIER -131.8 141.95 49.6 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.684 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.501 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.05 -21.42 15.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.266 0.555 . . . . 0.0 109.679 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.608 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.66 135.29 33.09 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.781 -178.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -124.51 133.6 53.28 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 175.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.608 HD11 HD12 ' B' ' 48' ' ' LEU . 2.4 mp -125.45 132.37 71.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.474 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.4 mm? -113.55 121.99 45.89 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.3 103.13 11.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 177.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.42 ' HB3' HG23 ' B' ' 106' ' ' THR . 14.0 pt-20 -114.99 153.41 30.67 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.106 0.479 . . . . 0.0 110.305 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -95.94 110.2 22.45 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.423 -177.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -130.04 94.11 3.64 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.868 0.842 . . . . 0.0 110.536 178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.548 ' HB3' ' HB2' ' B' ' 59' ' ' SER . . . -133.84 157.8 76.96 Favored Pre-proline 0 C--N 1.311 -1.084 0 CA-C-N 115.075 -0.966 . . . . 0.0 110.515 179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.03 -22.95 76.36 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.982 2.455 . . . . 0.0 111.531 174.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -139.64 -91.02 0.18 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.324 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.548 ' HB2' ' HB3' ' B' ' 56' ' ' ALA . 44.1 t 70.01 138.93 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 122.031 0.919 . . . . 0.0 111.97 178.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -137.66 79.11 35.49 Favored Pre-proline 0 C--N 1.313 -0.996 0 CA-C-N 114.663 -1.153 . . . . 0.0 108.786 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -60.87 137.02 69.8 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.081 2.521 . . . . 0.0 112.634 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . 0.494 ' OD2' ' HG2' ' B' ' 63' ' ' ARG . 22.2 t70 -81.79 -74.14 0.35 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.656 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.494 ' HG2' ' OD2' ' B' ' 62' ' ' ASP . 20.1 ptt180 -166.87 175.29 7.83 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 175.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -115.16 116.0 27.66 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.786 0.327 . . . . 0.0 110.961 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -136.92 79.64 38.34 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-O 121.096 0.474 . . . . 0.0 109.782 175.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -80.03 158.38 23.83 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.982 2.455 . . . . 0.0 113.486 -178.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 90.8 p -158.56 147.89 19.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.074 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.441 ' HB2' HD23 ' B' ' 75' ' ' LEU . 53.8 t80 -106.95 117.97 35.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.196 0.522 . . . . 0.0 110.847 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.486 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.5 p-10 -100.02 110.18 22.5 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.526 176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -60.52 -33.58 72.85 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.66 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -51.79 -44.14 63.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.719 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.446 ' O ' HG13 ' B' ' 74' ' ' ILE . 4.1 mm-40 -111.56 4.0 18.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.46 44.9 17.08 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 114.881 -1.054 . . . . 0.0 111.422 -176.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.446 HG13 ' O ' ' B' ' 72' ' ' GLU . 55.6 mt -121.74 135.05 63.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.163 -178.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.441 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -100.84 100.85 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.0 OUTLIER -84.83 144.63 28.3 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -177.757 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.8 mm -98.41 -59.57 3.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.299 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -144.88 -178.04 5.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.419 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.98 3.61 27.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.749 176.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -90.21 -40.56 12.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.505 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.4 pp -160.22 153.29 21.68 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.624 -0.717 . . . . 0.0 112.224 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 23.9 p -121.07 147.56 45.36 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.65 174.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.0 mm -102.71 103.99 36.02 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.852 0.358 . . . . 0.0 110.344 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.432 ' HA ' HG12 ' B' ' 74' ' ' ILE . 72.3 Cg_endo -81.88 130.38 6.62 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.281 1.988 . . . . 0.0 112.599 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -96.86 147.2 32.57 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.955 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.465 ' HG2' HD12 ' B' ' 89' ' ' ILE . 31.2 Cg_endo -65.36 140.65 64.77 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.199 1.932 . . . . 0.0 111.343 175.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.4 ' NH1' ' HA ' ' B' ' 86' ' ' PRO . 0.1 OUTLIER -73.14 -5.74 41.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.429 -175.851 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -81.5 -11.57 59.15 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.311 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.465 HD12 ' HG2' ' B' ' 86' ' ' PRO . 58.8 mt -114.84 136.64 50.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.902 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.1 p -84.51 113.41 23.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.215 0.531 . . . . 0.0 109.971 175.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 62.1 t -120.49 130.72 74.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-O 121.122 0.487 . . . . 0.0 111.128 -175.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.541 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.43 164.43 30.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.912 177.962 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.4 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.22 -18.01 63.06 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.871 -176.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.4 -14.82 48.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.831 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.541 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 20.4 t70 -108.67 -23.98 11.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.837 -175.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.442 HG22 HG13 ' B' ' 98' ' ' ILE . 80.5 mt -73.45 115.33 14.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.18 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -110.09 98.82 8.01 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.575 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.496 HG22 HG23 ' A' ' 10' ' ' VAL . 39.2 mt -99.84 116.72 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.005 0.431 . . . . 0.0 110.766 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -130.66 121.34 25.38 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.095 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.453 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 75.6 t60 -109.54 125.29 52.35 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.047 0.451 . . . . 0.0 110.882 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.54 HG22 ' H ' ' B' ' 104' ' ' GLU . 85.4 mt -104.12 113.02 39.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.973 177.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -72.51 -23.38 61.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.709 0.29 . . . . 0.0 110.573 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.31 -49.17 78.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.106 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.54 ' H ' HG22 ' B' ' 101' ' ' ILE . 42.7 mt-10 -95.23 0.67 54.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.135 0.493 . . . . 0.0 109.985 177.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 51.71 37.29 19.79 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.207 -173.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.42 HG23 ' HB3' ' B' ' 53' ' ' GLU . 62.4 m -121.52 133.98 55.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.535 -173.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.33 118.16 36.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.964 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.515 ' HB3' ' CE1' ' B' ' 110' ' ' TYR . 29.8 m-85 -98.12 119.05 36.09 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.9 179.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.492 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.3 mm -108.99 123.0 64.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.843 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 67.7 m-85 -122.53 126.64 48.21 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.571 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.4 mt . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.776 -0.631 . . . . 0.0 109.775 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.725 0 N-CA-C 111.749 -0.54 . . . . 0.0 111.749 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.43 81.82 0.71 Allowed 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.057 2.505 . . . . 0.0 113.118 -175.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.489 ' HB3' ' HB2' ' B' ' 71' ' ' ALA . 46.7 t60 175.33 -54.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.4 ' SD ' HG13 ' A' ' 6' ' ' VAL . 0.0 OUTLIER 176.48 135.33 0.06 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 114.917 -1.038 . . . . 0.0 108.877 179.365 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.439 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 13.4 p -145.24 126.05 14.36 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.809 0.338 . . . . 0.0 110.589 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.4 HG13 ' SD ' ' A' ' 4' ' ' MET . 15.3 m -114.79 140.86 33.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.203 -177.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.417 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.4 OUTLIER -86.11 139.11 31.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.098 -179.865 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.547 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.0 mm -111.36 117.2 49.83 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.362 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -71.24 129.68 16.4 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.321 2.014 . . . . 0.0 112.428 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.07 137.07 21.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.406 HG12 HG13 ' A' ' 13' ' ' VAL . 67.6 t -101.15 112.95 35.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.56 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.0 mt-10 -94.98 107.88 19.92 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.418 0.628 . . . . 0.0 110.754 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.406 HG13 HG12 ' A' ' 11' ' ' VAL . 2.7 m -127.84 -173.27 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.631 -175.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.47 -33.57 36.57 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -175.46 175.78 2.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.741 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.453 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.9 mm? -78.17 140.66 61.6 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-O 120.772 0.32 . . . . 0.0 110.844 -177.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -68.97 173.65 9.95 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.81 2.34 . . . . 0.0 111.738 174.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -56.82 139.4 51.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.014 0.435 . . . . 0.0 110.952 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.04 -22.48 23.14 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.647 -178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.422 ' HB2' ' HB3' ' A' ' 16' ' ' LEU . 66.7 m-85 -93.7 166.55 12.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.441 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -124.9 99.49 6.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.386 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.521 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 57.9 ttp85 -97.08 147.57 23.9 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.681 -178.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.8 m . . . . . 0 C--O 1.251 1.18 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.302 178.786 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo . . . . . 0 N--CA 1.482 0.817 0 N-CA-C 110.511 -0.611 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -119.99 123.71 44.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.751 0.31 . . . . 0.0 110.942 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -87.8 99.35 12.04 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 174.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -85.56 145.39 27.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.064 -177.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -112.19 177.96 4.47 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.648 0.737 . . . . 0.0 111.152 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -120.98 -4.06 9.6 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.93 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -88.4 -8.69 54.6 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.567 -1.197 . . . . 0.0 109.881 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.53 114.5 13.35 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.328 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.54 130.0 11.42 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.716 2.278 . . . . 0.0 112.361 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.411 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 35.0 tt0 -92.48 100.33 12.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 175.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.481 ' HB2' HD21 ' B' ' 81' ' ' LEU . 68.0 m-85 -87.19 153.88 21.16 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.417 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -132.87 116.59 16.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.558 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.7 p -102.27 132.3 48.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.01 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.61 151.35 44.94 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.701 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.0 OUTLIER -128.55 137.46 51.75 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -177.323 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.418 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 2.5 tmtp? -143.68 132.37 22.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.611 0.244 . . . . 0.0 110.413 -174.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.418 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.3 OUTLIER -95.65 141.4 29.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.335 -177.018 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -121.13 147.12 46.01 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 176.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -119.43 118.54 31.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.941 178.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.23 51.77 46.81 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.562 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -132.9 171.7 13.58 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.57 -16.95 62.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.251 0.548 . . . . 0.0 110.74 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.614 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -133.53 144.18 49.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.916 176.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.512 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.7 mppt? -98.87 -23.53 15.32 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -178.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.701 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -137.63 134.94 36.09 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.222 -179.125 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -120.18 117.89 29.07 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -111.91 130.41 65.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -179.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.558 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.1 mm? -112.62 112.85 24.68 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.375 -176.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.16 103.38 14.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.527 ' HB3' HG23 ' B' ' 106' ' ' THR . 10.3 pt-20 -113.28 150.31 32.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.026 0.441 . . . . 0.0 110.68 -176.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -94.93 113.7 25.46 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.021 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 ptmm? -137.26 93.03 2.77 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.492 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.502 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -132.63 162.09 59.39 Favored Pre-proline 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.577 175.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -60.7 -41.71 44.75 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.375 2.05 . . . . 0.0 110.454 171.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -142.48 99.29 3.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.718 -1.128 . . . . 0.0 109.194 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.502 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 5.5 p -133.03 138.22 46.72 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.616 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.506 ' HE2' ' HA ' ' B' ' 60' ' ' LYS . 6.6 mmpt? -131.87 75.0 76.52 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.478 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -77.71 138.25 16.84 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.201 1.934 . . . . 0.0 111.469 172.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -108.04 -49.12 3.26 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.926 -177.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 22.8 ptt180 -157.94 176.45 12.53 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.421 -175.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -133.03 143.87 49.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.523 -178.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.6 p -133.45 78.74 62.14 Favored Pre-proline 0 C--N 1.319 -0.761 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 172.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.459 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 86.3 Cg_endo -83.81 152.93 13.12 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.679 2.253 . . . . 0.0 112.158 179.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . 0.491 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.9 m -156.03 141.63 17.8 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.184 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.433 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 51.0 t80 -99.52 129.41 45.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.326 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.577 HD21 ' HB2' ' B' ' 72' ' ' GLU . 0.0 OUTLIER -108.28 131.09 55.07 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.562 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -79.02 -24.28 43.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.332 -178.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.489 ' HB2' ' HB3' ' A' ' 3' ' ' HIS . . . -62.96 -51.71 65.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.099 0.476 . . . . 0.0 110.988 -176.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.577 ' HB2' HD21 ' B' ' 69' ' ' ASN . 3.6 mt-10 -104.86 -2.34 24.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.284 178.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 58.94 39.62 23.47 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.171 0.986 . . . . 0.0 110.229 174.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.577 HG13 ' O ' ' B' ' 72' ' ' GLU . 86.2 mt -118.67 136.3 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 114.447 -1.252 . . . . 0.0 111.131 -177.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.405 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.9 tm? -100.1 100.52 11.39 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 177.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.491 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -87.68 141.18 28.81 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.168 -0.613 . . . . 0.0 109.587 -178.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 46.8 mm -90.94 -49.64 13.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.89 -175.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.2 m-20 -157.92 -170.54 3.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.39 21.19 5.35 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.398 178.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -107.07 -47.17 3.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.31 0.576 . . . . 0.0 110.038 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -151.1 153.08 34.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.296 -178.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 24.1 p -126.97 145.51 50.67 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.951 178.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.5 102.75 39.43 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-O 120.817 0.341 . . . . 0.0 110.66 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.464 ' HA ' HG12 ' B' ' 74' ' ' ILE . 74.1 Cg_endo -78.74 134.59 12.21 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.157 1.905 . . . . 0.0 112.3 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -98.49 153.27 38.06 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.464 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.436 ' HG2' HD12 ' B' ' 89' ' ' ILE . 37.1 Cg_endo -66.59 140.61 57.48 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.488 2.126 . . . . 0.0 111.322 175.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.61 -8.66 57.33 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.211 -176.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.75 -13.35 59.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.282 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.436 HD12 ' HG2' ' B' ' 86' ' ' PRO . 57.7 mt -114.15 135.15 54.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.895 -177.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 90.7 t -86.79 114.47 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . 0.433 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.0 p -123.44 134.85 65.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.329 0.585 . . . . 0.0 111.325 -175.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.501 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.06 166.43 24.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.546 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.6 -12.26 60.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.749 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.63 -9.87 48.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.37 0.605 . . . . 0.0 110.637 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.501 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.2 t70 -111.39 -24.1 10.39 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.766 -178.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.406 HG22 HG13 ' B' ' 98' ' ' ILE . 82.4 mt -73.73 120.1 22.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.284 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.452 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 12.0 mmmm -113.82 103.05 10.81 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.69 178.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.547 HD12 ' HB ' ' A' ' 8' ' ' ILE . 37.5 mt -105.75 120.98 57.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 CA-C-O 120.98 0.419 . . . . 0.0 111.439 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -132.85 121.25 22.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.472 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.56 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 15.5 t-80 -105.24 117.9 35.19 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.42 179.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.702 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.3 mp -91.49 125.34 44.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 173.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.445 ' HD3' ' OE2' ' A' ' 12' ' ' GLU . 12.1 mmm180 -76.22 -42.61 45.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.465 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . 0.417 ' HE3' ' HB2' ' B' ' 103' ' ' LYS . 36.0 ttmt -59.53 -47.82 84.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.681 -175.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.702 ' H ' HG22 ' B' ' 101' ' ' ILE . 16.0 mm-40 -87.47 -3.94 59.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.859 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 53.54 38.97 29.37 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.858 -175.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.527 HG23 ' HB3' ' B' ' 53' ' ' GLU . 59.6 m -125.92 137.87 53.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.93 0.395 . . . . 0.0 111.097 -172.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . 0.487 HD13 ' HB2' ' B' ' 100' ' ' HIS . 27.5 tp -109.23 119.72 40.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.181 178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.564 ' CE1' HD13 ' B' ' 101' ' ' ILE . 47.4 m-85 -102.11 129.16 48.38 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.776 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.2 mm -115.39 118.43 58.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.808 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 85.7 m-85 -117.18 125.7 51.62 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.614 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 74.2 mt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.655 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.717 0 N-CA-C 112.087 -0.405 . . . . 0.0 112.087 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -60.69 119.84 7.24 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.795 2.33 . . . . 0.0 111.895 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.501 ' HA ' ' HB2' ' B' ' 71' ' ' ALA . 42.9 m80 -90.39 64.32 5.89 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.841 -177.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 48.1 ttm -93.86 129.79 40.14 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.338 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.444 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 33.1 p -135.46 127.28 29.31 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.064 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.4 m -117.45 143.01 29.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.752 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.442 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -87.82 137.47 32.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.308 -178.074 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.451 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.3 mm -109.78 114.94 56.12 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.31 128.69 14.01 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.292 1.995 . . . . 0.0 112.269 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 57.9 t -81.52 132.67 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.111 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.467 HG12 HG13 ' A' ' 13' ' ' VAL . 79.4 t -94.72 114.55 31.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 174.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.487 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 23.0 mt-10 -91.1 111.2 22.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.549 0.69 . . . . 0.0 110.811 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.467 HG13 HG12 ' A' ' 11' ' ' VAL . 2.6 m -127.55 179.26 3.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.513 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -89.84 -28.05 19.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.147 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -169.64 164.14 10.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.977 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.516 HD22 ' HD2' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -78.92 143.72 62.47 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-O 120.692 0.282 . . . . 0.0 110.331 -178.351 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -71.35 175.04 9.92 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.917 2.412 . . . . 0.0 112.44 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -48.94 138.57 11.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.707 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.1 -5.09 61.09 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.166 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -106.49 149.23 27.3 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.172 0.51 . . . . 0.0 111.653 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -110.68 98.09 7.34 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.245 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.516 ' HD2' HD22 ' A' ' 16' ' ' LEU . 10.0 ttt180 -80.21 143.86 33.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.181 -178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.4 t . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.373 -0.822 . . . . 0.0 110.238 -176.514 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.476 0.486 0 N-CA-C 109.996 -0.809 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 7.2 t-160 -66.9 -54.86 18.0 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 62.12 102.29 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.72 0.637 . . . . 0.0 111.373 176.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -76.47 158.91 30.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.448 0.642 . . . . 0.0 111.309 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -97.56 154.38 17.56 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.326 -177.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -94.45 -14.38 25.26 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.631 -172.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.56 ' OD2' ' HE3' ' B' ' 60' ' ' LYS . 7.2 p-10 -83.36 -13.43 54.99 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.814 177.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 63.8 t -68.41 119.71 70.03 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.441 177.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.458 ' HA ' ' CB ' ' B' ' 59' ' ' SER . 36.6 Cg_endo -69.37 129.73 18.55 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.346 2.03 . . . . 0.0 111.723 177.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.512 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 32.8 tt0 -105.74 99.19 8.8 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.488 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.461 ' HB2' HD21 ' B' ' 81' ' ' LEU . 81.3 m-85 -87.06 137.77 32.06 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.498 178.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.522 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 36.1 tt0 -110.19 113.7 26.59 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.04 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 96.8 t -93.98 124.06 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.917 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -118.58 131.76 56.2 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.22 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.652 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -118.91 135.78 54.4 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -176.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.492 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 5.3 tmtm? -142.57 131.65 23.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.869 0.366 . . . . 0.0 110.775 -173.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.492 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.4 OUTLIER -90.5 132.04 35.9 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.927 -179.529 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -116.69 149.01 40.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.904 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -132.29 122.62 25.42 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.547 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.03 23.85 58.65 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.307 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -113.28 170.8 7.96 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.79 -11.01 60.53 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 177.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.59 142.05 43.32 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.568 177.102 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.493 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.29 -19.69 18.38 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.148 0.499 . . . . 0.0 109.752 -175.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.652 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -135.83 132.76 37.06 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.65 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -115.93 122.02 44.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.202 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.607 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -121.41 128.95 75.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.555 HD11 ' CD2' ' B' ' 108' ' ' TYR . 3.7 mm? -114.83 120.61 40.6 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -122.12 103.56 13.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.421 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.3 pt-20 -113.06 153.49 28.05 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.147 0.499 . . . . 0.0 110.312 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.51 111.33 23.7 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.343 -176.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.405 ' HB2' ' HE2' ' B' ' 55' ' ' LYS . 7.6 ptmm? -134.7 92.19 2.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.182 0.515 . . . . 0.0 110.837 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.788 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -137.34 162.05 57.38 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.276 176.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.6 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 10.1 Cg_endo -49.5 -43.91 37.01 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.3 2.667 . . . . 0.0 112.176 -175.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -130.76 -67.28 0.72 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.996 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.788 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 53.3 p 58.37 131.14 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 173.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.56 ' HE3' ' OD2' ' B' ' 30' ' ' ASP . 21.6 pttp -120.6 83.15 34.39 Favored Pre-proline 0 N--CA 1.446 -0.651 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.755 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -59.47 140.31 93.51 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.693 2.262 . . . . 0.0 111.728 176.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -90.08 -76.15 0.43 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.706 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -159.31 176.33 12.29 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.185 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -126.36 108.97 11.73 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.14 0.495 . . . . 0.0 110.539 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.4 t -134.66 79.63 52.58 Favored Pre-proline 0 C--N 1.317 -0.812 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.039 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.08 158.18 13.36 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.813 2.342 . . . . 0.0 112.019 -179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.3 m -158.1 144.57 17.53 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.038 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.437 ' HB2' HD23 ' B' ' 75' ' ' LEU . 72.2 t80 -104.34 128.95 52.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.358 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.476 ' OD1' ' HB3' ' B' ' 71' ' ' ALA . 0.1 OUTLIER -109.69 125.33 52.52 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.632 178.311 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -75.72 -24.82 56.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.444 -175.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.501 ' HB2' ' HA ' ' A' ' 3' ' ' HIS . . . -62.28 -42.0 98.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.492 -175.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.524 ' O ' HD13 ' B' ' 74' ' ' ILE . 12.6 mt-10 -112.96 -7.81 13.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.291 178.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 60.52 42.35 14.36 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 124.644 1.215 . . . . 0.0 110.38 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.524 HD13 ' O ' ' B' ' 72' ' ' GLU . 0.2 OUTLIER -107.67 138.51 33.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.008 178.266 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.8 tm? -106.33 99.86 9.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.12 144.66 27.4 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -176.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 42.7 mm -105.25 -49.37 9.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.076 0.465 . . . . 0.0 111.193 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -146.65 174.31 11.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -175.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.82 4.75 28.04 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.437 -0.887 . . . . 0.0 111.255 174.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 30.2 mttp -101.43 -34.57 9.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.906 -0.647 . . . . 0.0 110.424 -177.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.5 OUTLIER -157.62 152.51 25.48 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.56 0.695 . . . . 0.0 111.989 -177.173 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 28.4 p -133.3 143.61 49.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.805 178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 47.5 mm -101.76 106.48 47.1 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.475 -177.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.497 ' HA ' HD12 ' B' ' 74' ' ' ILE . 73.4 Cg_endo -82.1 135.12 8.42 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.135 1.89 . . . . 0.0 112.343 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -99.59 149.05 35.54 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.55 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.425 ' HG2' HD12 ' B' ' 89' ' ' ILE . 32.5 Cg_endo -68.34 142.47 54.88 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.148 1.899 . . . . 0.0 111.337 175.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.462 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 8.9 mpt_? -78.74 -0.06 28.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.682 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -81.78 -15.61 53.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.043 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.425 HD12 ' HG2' ' B' ' 86' ' ' PRO . 51.5 mt -109.98 134.12 53.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.979 -176.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.96 114.38 25.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.64 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 51.4 t -120.6 135.5 60.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 121.303 0.573 . . . . 0.0 111.246 -173.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.527 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.07 161.15 38.54 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.708 177.483 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.72 64.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.799 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.62 -16.03 49.91 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.061 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.527 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.1 t0 -104.05 -22.21 13.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.603 0.715 . . . . 0.0 109.706 -177.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.2 mt -73.99 119.28 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 114.792 -1.094 . . . . 0.0 111.276 178.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -113.14 108.86 17.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.856 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.451 HD12 ' HB ' ' A' ' 8' ' ' ILE . 55.5 mt -113.33 119.5 60.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.885 0.374 . . . . 0.0 111.296 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -128.56 117.7 21.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -178.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.487 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 32.3 t-80 -100.08 121.18 41.0 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.98 0.419 . . . . 0.0 110.606 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.687 HG22 ' H ' ' B' ' 104' ' ' GLU . 70.5 mt -102.84 104.84 17.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 173.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -79.05 -18.05 54.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.186 -176.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.93 -44.33 85.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.424 0.631 . . . . 0.0 109.995 174.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.687 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.8 tp10 -94.24 -4.42 48.91 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.083 -178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 57.1 35.1 25.88 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.738 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.416 HG23 ' HB3' ' B' ' 53' ' ' GLU . 61.4 m -126.65 137.3 53.28 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.851 -174.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.4 tp -106.52 125.31 50.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.277 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.603 ' CE1' HD12 ' B' ' 101' ' ' ILE . 21.6 m-85 -105.82 126.14 51.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.835 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.607 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.0 mm -116.48 124.92 73.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.027 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.415 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.2 m-85 -126.63 126.79 44.17 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.527 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.5 mt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.006 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.0 124.2 13.15 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.842 2.362 . . . . 0.0 111.844 178.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' B' ' 70' ' ' PHE . 33.6 m170 -78.81 49.05 0.87 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.746 -178.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 64.96 175.55 0.2 Allowed 'General case' 0 C--O 1.236 0.356 0 CA-C-O 122.027 0.918 . . . . 0.0 113.028 176.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 p -152.07 129.22 11.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.323 177.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 16.3 m -112.39 142.81 23.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.91 0.386 . . . . 0.0 110.875 -176.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.479 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -86.82 137.66 32.23 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.24 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' B' ' 67' ' ' SER . 8.0 mm -109.11 121.79 41.74 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.874 -0.331 . . . . 0.0 110.272 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -70.2 127.83 14.78 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.368 2.045 . . . . 0.0 112.226 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.458 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -101.94 130.94 50.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.449 HG12 HG13 ' A' ' 13' ' ' VAL . 50.7 t -97.35 121.65 48.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.923 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.531 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 44.4 mt-10 -95.49 106.28 18.34 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.186 0.517 . . . . 0.0 110.799 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.535 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 3.6 m -128.79 -175.12 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.979 -177.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -99.46 -23.07 15.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.248 0.547 . . . . 0.0 109.879 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.73 156.3 36.11 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.87 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.91 146.09 48.25 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -69.24 173.66 10.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.553 2.168 . . . . 0.0 112.15 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -52.02 140.09 21.22 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.966 -177.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.34 -20.32 42.9 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.057 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -89.79 147.37 23.85 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.07 0.462 . . . . 0.0 111.509 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -108.02 106.47 16.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.477 -176.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -117.88 151.45 37.36 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.501 177.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.044 -176.87 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.371 0 N-CA-C 110.057 -0.786 . . . . 0.0 110.057 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 49.0 m80 58.02 55.7 5.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.455 0.645 . . . . 0.0 110.838 -177.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.11 148.72 46.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.293 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -97.0 175.16 6.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.201 0.524 . . . . 0.0 111.352 -177.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . 0.517 ' HB2' HG23 ' B' ' 31' ' ' VAL . 24.9 mt-30 -144.38 155.37 43.75 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.194 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.48 ' O ' ' HB2' ' B' ' 58' ' ' ASN . 10.1 pt-20 -74.03 -20.58 60.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.747 -173.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -89.56 -4.35 57.9 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.326 -177.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.517 HG23 ' HB2' ' B' ' 28' ' ' GLN . 21.6 t -79.32 116.77 62.9 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.309 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -65.4 128.94 21.37 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.145 1.896 . . . . 0.0 111.571 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.564 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 33.9 tt0 -108.46 101.51 10.68 Favored 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.509 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 84.7 m-85 -81.87 148.36 28.84 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -124.35 115.32 20.81 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.595 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 1.6 p -102.41 134.86 41.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.94 -173.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.426 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -126.19 147.23 49.69 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.182 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.618 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.2 OUTLIER -121.85 135.88 54.91 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.618 -178.464 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.506 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 4.9 tmtm? -137.05 131.94 33.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.336 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.423 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.6 OUTLIER -95.23 137.23 34.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.857 0.36 . . . . 0.0 111.101 -179.504 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.506 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 39.5 m-85 -119.62 160.5 22.37 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.733 175.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -143.08 121.55 12.41 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 76.8 29.58 57.24 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.447 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.03 171.73 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.44 -12.77 55.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.172 0.511 . . . . 0.0 110.485 177.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.539 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -137.75 146.55 43.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.379 -0.828 . . . . 0.0 108.862 177.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.502 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -100.58 -21.52 15.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.247 0.546 . . . . 0.0 109.609 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.618 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -137.03 136.99 38.91 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.352 -178.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 62.9 ttp180 -124.38 121.6 35.38 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.599 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.2 mp -113.73 129.86 68.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.595 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 4.4 mm? -112.36 115.09 28.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.136 -177.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.0 103.56 14.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -109.48 153.31 24.24 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.475 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.46 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -94.74 114.44 26.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.994 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.442 ' N ' HD22 ' B' ' 54' ' ' ASN . 16.4 ptmt -137.94 92.18 2.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.282 0.563 . . . . 0.0 110.89 176.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.736 ' HB3' ' OG ' ' B' ' 59' ' ' SER . . . -136.43 167.39 21.78 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 174.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.616 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 3.3 Cg_endo -45.1 -43.47 15.98 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.436 2.757 . . . . 0.0 112.448 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' B' ' 29' ' ' GLU . 29.6 m-80 -129.7 -67.4 0.76 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.128 -177.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.736 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 15.4 m 67.93 120.82 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.711 -178.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.593 ' O ' ' HG3' ' B' ' 60' ' ' LYS . 21.2 pttm -118.91 81.22 19.02 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-O 121.649 0.738 . . . . 0.0 109.44 176.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -52.44 124.13 14.38 Favored 'Trans proline' 0 CA--C 1.513 -0.566 0 C-N-CA 122.924 2.416 . . . . 0.0 112.558 -177.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . 0.489 ' OD2' ' HD2' ' B' ' 63' ' ' ARG . 12.0 t70 -92.33 -73.3 0.56 Allowed 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 113.856 -1.52 . . . . 0.0 109.891 -177.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.489 ' HD2' ' OD2' ' B' ' 62' ' ' ASP . 0.1 OUTLIER -160.5 175.85 12.27 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 174.388 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -126.72 120.6 29.79 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.796 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 14.7 m -129.25 78.35 76.11 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 0.0 109.781 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 61.0 Cg_endo -81.45 145.37 14.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.317 2.011 . . . . 0.0 112.136 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . 0.562 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 12.5 m -155.38 144.11 20.56 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.246 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.404 ' HE2' ' CD2' ' B' ' 70' ' ' PHE . 65.2 t80 -105.3 120.37 41.4 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.52 -177.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.505 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.1 p-10 -99.74 114.95 28.41 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.424 175.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 3' ' ' HIS . 85.1 m-85 -63.88 -32.12 73.53 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.42 -176.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.27 -41.81 69.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.973 -176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.534 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.98 1.79 15.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.623 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.73 45.55 21.76 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 124.363 1.039 . . . . 0.0 111.32 -175.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.534 HG13 ' O ' ' B' ' 72' ' ' GLU . 72.3 mt -123.26 137.62 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.135 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -105.8 107.05 17.84 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.564 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 10.8 p90 -95.36 144.82 25.59 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.165 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 49.3 mm -91.8 -40.77 12.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.721 -175.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 22.9 m-20 -161.16 -175.96 5.17 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.48 7.31 40.17 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.505 -0.855 . . . . 0.0 111.586 175.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 32.5 mttp -94.46 -37.99 11.15 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.074 0.464 . . . . 0.0 110.21 -178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.485 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -159.26 153.01 22.99 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.944 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 10.1 p -128.16 141.62 51.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.642 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 45.5 mm -104.69 105.62 51.34 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.852 0.358 . . . . 0.0 110.673 -178.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.442 ' HA ' HG12 ' B' ' 74' ' ' ILE . 73.6 Cg_endo -80.9 134.51 9.55 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.188 1.925 . . . . 0.0 112.632 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.48 143.84 27.17 Favored Pre-proline 0 C--N 1.321 -0.649 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.76 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -67.27 142.2 59.63 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.133 1.889 . . . . 0.0 111.306 177.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? -71.26 -5.01 28.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.125 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -75.31 -17.07 60.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.45 0.643 . . . . 0.0 109.709 178.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 53.5 mt -113.7 137.71 45.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.764 -176.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 60.6 t -90.64 113.9 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 2.3 p -124.53 134.57 66.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.155 0.502 . . . . 0.0 111.185 -175.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -141.05 167.32 22.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.302 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.58 -23.68 64.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 111.556 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.89 -9.8 58.46 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.033 -177.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -113.89 -21.1 10.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.021 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 79.5 mt -75.33 117.97 20.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.354 177.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.418 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 10.8 mmmm -113.07 107.83 16.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.68 178.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.458 HG22 HG23 ' A' ' 10' ' ' VAL . 46.7 mt -110.38 120.77 61.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 0.0 111.518 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -133.23 119.52 19.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.614 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 16.9 t-80 -101.82 113.89 27.47 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.628 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.649 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.4 mt -89.93 108.43 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -69.2 -40.65 77.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.716 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -58.6 -47.44 84.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.108 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.649 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.3 tp10 -87.06 -3.19 59.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.191 -176.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 31.6 mmt180 59.3 27.85 17.02 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.726 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 35.0 m -124.43 134.42 53.08 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.116 0.484 . . . . 0.0 111.231 -171.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' B' ' 100' ' ' HIS . 37.5 tp -103.6 123.13 46.38 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.098 177.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.588 ' CE1' HD12 ' B' ' 101' ' ' ILE . 14.8 m-85 -103.83 124.43 48.92 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.894 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.599 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.9 mm -112.23 120.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.619 175.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.494 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.3 m-85 -118.63 125.87 50.7 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 71.7 mt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.642 -0.694 . . . . 0.0 109.986 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.76 155.33 70.38 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.629 2.219 . . . . 0.0 111.218 177.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -124.51 9.71 8.44 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -176.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 23.7 mmt -91.35 -177.76 4.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.041 0.448 . . . . 0.0 111.039 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 p -134.26 141.25 46.92 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.684 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.479 HG21 ' HB2' ' B' ' 93' ' ' ALA . 27.6 m -134.09 164.32 34.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.349 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -110.03 153.75 24.18 Favored 'General case' 0 N--CA 1.441 -0.909 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.446 ' HB ' HD12 ' B' ' 98' ' ' ILE . 5.2 mm -118.74 128.24 26.08 Favored Pre-proline 0 C--N 1.307 -1.25 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.413 -174.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.98 135.07 24.63 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.452 2.102 . . . . 0.0 111.939 177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.493 HG23 HG22 ' B' ' 98' ' ' ILE . 2.6 p -113.64 130.81 67.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.173 0.511 . . . . 0.0 110.566 178.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.76 HG12 ' HA ' ' B' ' 99' ' ' PHE . 4.0 p -86.22 149.03 4.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.512 -179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.581 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 34.6 mt-10 -115.81 94.46 4.69 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.595 0.712 . . . . 0.0 110.225 170.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.429 HG13 HG22 ' A' ' 11' ' ' VAL . 10.2 m -114.16 179.72 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.492 -177.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -95.62 -24.9 16.37 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.365 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -168.36 163.0 12.78 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.415 176.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 30.4 mt -83.48 154.02 65.57 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-O 121.066 0.46 . . . . 0.0 111.674 -175.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -72.08 165.93 31.13 Favored 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.894 2.396 . . . . 0.0 111.428 176.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.413 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 0.8 OUTLIER -61.54 136.36 57.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.341 -179.142 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.26 -4.75 29.99 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.817 -174.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -111.13 139.01 46.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.376 0.608 . . . . 0.0 111.856 176.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -93.74 94.69 8.7 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.81 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.621 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 31.6 ttp85 -97.49 145.72 25.94 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.27 0.557 . . . . 0.0 111.54 -175.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.402 ' H ' ' HE2' ' B' ' 108' ' ' TYR . 50.5 m . . . . . 0 C--O 1.248 1.0 0 CA-C-N 115.216 -0.902 . . . . 0.0 108.996 176.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo . . . . . 0 N--CA 1.481 0.749 0 N-CA-C 110.747 -0.52 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -166.13 -46.05 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.172 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -100.81 117.08 34.17 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.007 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -82.45 -177.67 6.77 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.056 0.455 . . . . 0.0 111.278 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -59.38 166.55 2.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.788 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -107.33 -8.93 16.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.604 177.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.35 -20.81 46.89 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.688 177.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -56.47 122.62 51.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.083 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -66.56 129.61 21.63 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.575 2.183 . . . . 0.0 111.973 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.519 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 22.3 tt0 -106.47 96.87 6.77 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.393 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.504 ' HB2' HD21 ' B' ' 81' ' ' LEU . 85.8 m-85 -86.04 157.68 20.02 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.497 -177.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.425 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 36.8 tt0 -131.51 119.18 21.19 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 171.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.79 136.32 27.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.466 -175.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.447 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -130.88 146.41 52.3 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 176.652 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.613 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.6 OUTLIER -124.75 136.64 54.04 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -177.332 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.479 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 3.1 tmtp? -136.58 129.49 30.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.742 0.306 . . . . 0.0 110.185 -175.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.474 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 6.7 mpt_? -97.11 134.3 40.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.023 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.479 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.0 m-85 -114.2 164.61 13.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.454 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -144.35 119.23 9.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.784 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 65.72 43.79 93.56 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.804 -177.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -124.56 171.35 10.08 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -19.24 65.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.293 0.568 . . . . 0.0 110.688 178.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.504 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -136.04 136.36 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 179.228 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 3.0 mppt? -87.68 -25.1 23.66 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.09 0.472 . . . . 0.0 110.041 -173.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.613 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -140.17 138.9 35.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.642 -178.215 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -122.97 119.9 31.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.709 175.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.584 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.0 mp -113.64 128.06 70.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.4 mm? -110.68 117.46 33.53 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.082 -178.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.3 mp -124.06 103.99 13.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.509 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.6 pt-20 -108.36 149.28 28.91 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.484 -178.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.62 113.0 24.53 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.768 -177.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -133.51 93.95 3.23 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.508 0.67 . . . . 0.0 110.74 178.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.519 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.09 161.59 61.61 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.807 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.489 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 11.9 Cg_endo -55.5 -45.16 41.78 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.223 1.948 . . . . 0.0 111.553 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -136.69 64.1 1.55 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.035 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 1.5 m -64.23 110.99 2.4 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.477 -176.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -138.92 78.04 30.69 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.625 175.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.94 149.59 90.24 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.601 2.201 . . . . 0.0 112.001 -178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -73.89 -38.21 64.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.68 -178.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -172.03 169.07 5.73 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.415 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -122.18 108.07 12.88 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 168.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.2 m -137.41 80.18 33.99 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-O 120.917 0.389 . . . . 0.0 110.096 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.95 150.02 23.17 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.587 2.192 . . . . 0.0 111.948 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 9.6 m -154.65 150.05 27.25 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.426 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.498 ' HB2' HD23 ' B' ' 75' ' ' LEU . 61.9 t80 -115.08 124.43 51.55 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.365 0.603 . . . . 0.0 111.19 -176.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.46 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.2 p-10 -105.03 113.43 27.02 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.389 174.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.403 ' CD2' ' HE2' ' B' ' 68' ' ' TYR . 88.1 m-85 -63.9 -32.82 74.48 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.907 -176.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.73 70.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.727 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.511 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.8 mt-10 -109.9 2.98 20.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.208 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 47.83 44.7 18.31 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.477 1.11 . . . . 0.0 111.36 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.511 HG13 ' O ' ' B' ' 72' ' ' GLU . 61.6 mt -121.49 134.16 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.484 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.498 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -101.95 107.09 18.13 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 176.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.38 140.61 29.41 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 41.2 mm -91.63 -59.62 2.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.051 0.453 . . . . 0.0 110.655 -178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -149.68 -179.48 7.14 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.326 -178.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.12 6.44 7.1 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.244 177.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -94.43 -43.41 8.38 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.506 ' O ' HD12 ' B' ' 81' ' ' LEU . 1.6 pp -157.82 153.72 26.89 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.708 -177.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 41.3 t -130.12 149.06 51.99 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.683 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.1 mm -112.6 105.77 55.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.897 0.38 . . . . 0.0 111.104 -174.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -79.04 136.86 13.3 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.352 2.034 . . . . 0.0 112.416 177.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -101.46 156.08 35.6 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.284 -179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.456 ' HG2' HD12 ' B' ' 89' ' ' ILE . 31.9 Cg_endo -64.92 141.06 69.29 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.31 2.007 . . . . 0.0 111.492 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.525 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 8.4 mpt_? -80.1 1.81 26.48 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.778 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -86.5 -20.28 28.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.286 0.565 . . . . 0.0 109.974 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.456 HD12 ' HG2' ' B' ' 86' ' ' PRO . 62.2 mt -103.99 134.61 44.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.601 -174.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.6 t -84.17 110.13 18.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.696 177.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 45.2 t -111.78 132.56 60.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.499 -175.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.604 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.78 161.15 38.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.78 178.757 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.479 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.29 -18.0 63.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.699 -176.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.65 -12.36 54.08 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.829 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.604 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 21.9 t70 -110.99 -24.04 10.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.097 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.407 HG22 HG13 ' B' ' 98' ' ' ILE . 84.6 mt -71.42 113.43 7.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.197 178.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.447 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.5 mmmt -109.54 105.7 15.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.93 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.493 HG22 HG23 ' A' ' 10' ' ' VAL . 57.0 mt -109.73 121.87 63.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.073 0.463 . . . . 0.0 111.69 -177.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.76 ' HA ' HG12 ' A' ' 11' ' ' VAL . 88.3 m-85 -129.07 118.41 22.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.627 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.581 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 19.9 t-80 -99.39 106.66 18.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.097 0.475 . . . . 0.0 109.859 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.61 HD12 ' CE1' ' B' ' 108' ' ' TYR . 70.4 mt -87.24 115.24 27.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.698 177.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 102' ' ' ARG . 33.2 mtp85 -77.25 -19.31 56.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.399 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -57.63 -48.56 79.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.767 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.51 ' H ' HG22 ' B' ' 101' ' ' ILE . 63.1 mm-40 -106.85 0.28 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.707 -179.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 54.07 40.54 31.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.83 -172.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.509 HG23 ' HB3' ' B' ' 53' ' ' GLU . 50.7 m -119.65 137.35 53.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.815 -174.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.75 119.6 39.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.424 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.621 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 24.5 m-85 -101.81 123.01 45.04 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.732 178.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.56 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.9 mm -113.19 119.44 60.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.947 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.447 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 88.8 m-85 -118.84 128.69 54.69 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 176.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.504 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 63.2 mt . . . . . 0 C--O 1.243 0.754 0 CA-C-O 118.728 -0.653 . . . . 0.0 109.352 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.793 0 N-CA-C 111.934 -0.466 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.73 -32.63 95.96 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 123.061 2.507 . . . . 0.0 112.773 -177.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -138.05 33.97 2.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.642 0.734 . . . . 0.0 109.511 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 13.8 tpt -58.88 125.43 23.52 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.738 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 5.0 p -153.46 144.51 22.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.592 -175.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -128.53 144.19 38.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.669 176.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.76 137.33 33.26 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.904 0.383 . . . . 0.0 110.004 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.417 ' HB ' HD12 ' B' ' 98' ' ' ILE . 10.4 mm -108.05 120.31 47.29 Favored Pre-proline 0 C--N 1.316 -0.849 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.13 127.7 16.37 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.23 1.953 . . . . 0.0 112.178 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.488 HG23 HG22 ' B' ' 98' ' ' ILE . 2.2 p -102.46 127.12 56.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.381 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.535 HG12 HG13 ' A' ' 13' ' ' VAL . 47.8 t -95.02 125.73 47.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.056 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.462 ' OE1' ' HD2' ' B' ' 102' ' ' ARG . 44.3 mt-10 -90.55 107.04 18.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.215 0.531 . . . . 0.0 110.253 178.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.672 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 11.0 m -126.63 177.4 5.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.357 -179.221 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -98.64 -16.97 18.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.008 0.432 . . . . 0.0 110.03 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -170.52 159.1 6.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.574 178.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.456 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.5 mm? -76.83 150.72 81.77 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 -177.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.08 172.83 13.14 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.272 1.981 . . . . 0.0 111.634 174.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.52 139.51 58.23 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.139 0.495 . . . . 0.0 111.004 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.83 -15.0 37.78 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.132 -177.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -95.35 166.71 11.75 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.89 0.376 . . . . 0.0 111.427 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -123.41 96.25 4.91 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.46 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.456 ' HB2' HD23 ' A' ' 16' ' ' LEU . 22.5 ttp85 -100.1 145.3 28.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.125 178.021 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.6 m . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.814 -179.699 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo . . . . . 0 N--CA 1.477 0.505 0 N-CA-C 110.454 -0.633 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -86.37 79.67 8.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.217 0.532 . . . . 0.0 110.282 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -96.05 160.58 14.38 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.946 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -116.85 142.56 46.77 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 121.014 0.435 . . . . 0.0 110.512 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . 0.503 ' H ' ' CG2' ' B' ' 31' ' ' VAL . 76.3 mm-40 -133.61 -166.96 1.86 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.994 178.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -83.75 -29.98 27.02 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.007 177.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -67.34 -20.68 65.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.482 -179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.503 ' CG2' ' H ' ' B' ' 28' ' ' GLN . 59.8 t -69.8 118.58 64.49 Favored Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-N 115.23 -0.895 . . . . 0.0 111.08 -176.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.528 ' HA ' ' HB3' ' B' ' 59' ' ' SER . 32.7 Cg_endo -67.84 130.82 22.63 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.878 2.385 . . . . 0.0 113.143 -179.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.631 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 39.0 tt0 -91.28 98.18 11.56 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.65 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -83.82 157.2 22.13 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.014 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -133.12 119.59 20.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.009 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.6 t -96.09 133.52 37.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.888 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.467 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.02 120.58 27.79 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.582 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.2 ttt -105.09 145.93 29.83 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.497 0.189 . . . . 0.0 110.614 -174.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.445 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 3.5 tmtp? -147.48 132.89 18.59 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -176.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.445 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -95.59 136.41 36.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.101 0.477 . . . . 0.0 110.86 179.702 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -117.57 167.65 11.12 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.363 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -156.59 109.43 2.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.938 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.4 11.85 46.85 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.305 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -111.69 171.59 7.4 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.15 -24.77 63.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.354 0.597 . . . . 0.0 110.706 178.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.652 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.4 p90 -124.42 142.75 51.06 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.859 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.467 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.9 mppt? -102.04 -18.55 15.56 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.98 -175.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.624 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -140.23 132.93 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.823 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -119.67 120.32 36.28 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 177.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.624 HD11 HD12 ' B' ' 48' ' ' LEU . 2.0 mp -118.05 129.21 74.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.497 HD11 ' CE2' ' B' ' 108' ' ' TYR . 4.5 mm? -114.03 114.58 26.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.188 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -118.43 103.41 14.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.2 pt-20 -110.33 152.92 25.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.262 0.554 . . . . 0.0 111.118 -176.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.433 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -94.6 113.35 25.15 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.053 -178.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -137.94 91.48 2.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.171 0.51 . . . . 0.0 110.467 176.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.631 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -138.67 162.2 54.3 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.016 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.433 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 36.3 Cg_endo -67.85 -43.04 5.62 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.136 1.891 . . . . 0.0 112.677 176.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 29.3 m-80 -128.31 36.35 4.29 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.052 0.453 . . . . 0.0 111.552 -171.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.528 ' HB3' ' HA ' ' B' ' 32' ' ' PRO . 1.1 p -72.1 124.93 26.03 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.097 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -132.38 75.28 74.4 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.844 175.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.34 143.04 62.36 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.852 2.368 . . . . 0.0 112.599 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -85.66 -72.12 0.5 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.858 178.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -156.81 -172.45 4.05 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.569 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -135.86 131.18 34.98 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.319 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 48.7 m -137.09 79.23 38.39 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-O 121.164 0.507 . . . . 0.0 109.829 172.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -76.27 153.0 35.55 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.865 2.377 . . . . 0.0 112.668 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.9 m -153.91 147.33 24.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.138 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -103.92 120.73 41.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.304 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.545 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.8 p-10 -100.2 112.38 24.7 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.386 176.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -63.1 -33.21 74.95 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.595 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.95 -41.13 77.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.875 -175.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.487 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -112.45 3.4 16.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.257 -179.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . 0.485 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.2 p-10 47.05 45.77 15.85 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.38 1.072 . . . . 0.0 111.616 -176.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.545 ' HB ' HD21 ' B' ' 69' ' ' ASN . 63.7 mt -121.4 139.29 48.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.065 -178.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -102.22 102.54 12.96 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.0 140.88 29.42 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -177.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -94.75 -54.43 7.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.469 -177.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -149.64 178.79 8.53 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.49 6.6 15.87 Favored Glycine 0 CA--C 1.517 0.184 0 C-N-CA 120.659 -0.781 . . . . 0.0 111.939 176.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -96.21 -37.3 10.61 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.13 0.49 . . . . 0.0 110.066 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.427 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -158.01 151.92 24.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.528 0.68 . . . . 0.0 112.094 178.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.0 p -128.78 148.72 50.88 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.67 177.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.418 HG21 HG12 ' B' ' 50' ' ' ILE . 49.5 mm -105.86 104.25 48.09 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.896 0.379 . . . . 0.0 110.391 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.494 ' HA ' HG12 ' B' ' 74' ' ' ILE . 61.4 Cg_endo -75.48 131.76 14.1 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.245 1.963 . . . . 0.0 112.211 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 54.0 mt -101.32 146.5 32.3 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.237 -175.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.437 ' HG2' HD12 ' B' ' 89' ' ' ILE . 33.0 Cg_endo -66.65 142.85 65.82 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.276 1.984 . . . . 0.0 111.4 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.485 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.2 mpt_? -78.24 1.01 22.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.533 -175.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -93.28 -1.4 56.12 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.579 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.437 HD12 ' HG2' ' B' ' 86' ' ' PRO . 60.0 mt -116.73 137.92 49.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.438 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 67.1 t -87.03 113.02 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 1.6 p -125.27 132.49 71.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.311 0.577 . . . . 0.0 111.393 -174.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.487 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -142.37 163.64 32.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.028 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.95 -20.23 63.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.844 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.67 -13.4 51.59 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.487 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 31.3 t70 -111.28 -21.19 12.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.111 -175.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.41 HG22 HG21 ' A' ' 8' ' ' ILE . 82.0 mt -75.73 118.56 22.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.169 179.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.47 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 28.1 mmmt -111.98 107.72 16.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.114 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.488 HG22 HG23 ' A' ' 10' ' ' VAL . 53.4 mt -111.42 121.43 63.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.983 0.421 . . . . 0.0 111.364 -178.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -132.66 122.53 24.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.205 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.433 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 45.3 t60 -102.86 110.7 22.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.998 0.428 . . . . 0.0 110.752 179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.761 HG22 ' H ' ' B' ' 104' ' ' GLU . 56.1 mt -91.16 114.18 28.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.195 177.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.462 ' HD2' ' OE1' ' A' ' 12' ' ' GLU . 39.5 mtp85 -81.06 -26.09 36.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.126 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.4 tttp -58.55 -42.31 87.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.337 177.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.761 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.6 tp10 -105.29 1.7 28.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.306 0.574 . . . . 0.0 110.002 -177.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 55.47 31.47 17.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.903 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' B' ' 53' ' ' GLU . 37.2 m -123.49 139.95 53.5 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 121.015 0.436 . . . . 0.0 110.939 -173.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.53 121.32 44.05 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.799 178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.637 ' CE1' HD12 ' B' ' 101' ' ' ILE . 8.4 m-85 -100.42 126.36 46.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.245 -176.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.57 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 39.0 mm -115.94 117.73 56.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.732 176.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.47 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 87.3 m-85 -119.01 123.04 43.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.652 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 68.1 mt . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.745 -0.645 . . . . 0.0 109.807 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.722 0 N-CA-C 111.846 -0.502 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -73.78 63.14 4.82 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.902 2.401 . . . . 0.0 112.39 179.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.516 ' O ' ' HB2' ' A' ' 4' ' ' MET . 37.8 t-80 -150.62 154.06 36.81 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.628 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' A' ' 3' ' ' HIS . 46.9 mmm 76.8 161.67 0.23 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.886 0.741 . . . . 0.0 112.094 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 39.2 p -129.93 137.63 50.46 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.73 176.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.466 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.0 m -120.66 140.1 45.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.013 -179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.435 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -86.54 139.45 30.84 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.768 -179.223 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.448 ' HB ' HD12 ' B' ' 98' ' ' ILE . 5.1 mm -112.13 119.6 43.67 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -70.54 128.73 15.71 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.236 1.957 . . . . 0.0 112.105 177.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG13 HG22 ' B' ' 98' ' ' ILE . 48.0 t -83.58 135.45 24.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.135 178.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.581 HG12 HG13 ' A' ' 13' ' ' VAL . 38.6 t -99.18 111.07 27.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.506 ' OE1' ' HD3' ' B' ' 102' ' ' ARG . 45.1 mt-10 -85.9 102.21 13.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.008 0.433 . . . . 0.0 110.605 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.581 HG13 HG12 ' A' ' 11' ' ' VAL . 5.8 m -123.16 -176.46 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.072 -178.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -94.43 -29.96 14.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -162.61 162.93 27.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.534 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.458 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -81.72 143.45 50.61 Favored Pre-proline 0 N--CA 1.448 -0.539 0 CA-C-O 120.776 0.322 . . . . 0.0 110.817 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -51.62 171.0 0.16 Allowed 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 123.931 3.087 . . . . 0.0 113.469 174.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -65.59 141.13 58.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.494 175.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.48 -4.6 60.09 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.493 -0.861 . . . . 0.0 111.22 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -100.71 164.76 11.72 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 174.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.48 94.36 4.12 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.042 0.449 . . . . 0.0 111.563 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.458 ' HB2' HD23 ' A' ' 16' ' ' LEU . 13.4 ttp180 -101.33 147.53 26.21 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.8 t . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.238 -175.831 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo . . . . . 0 N--CA 1.481 0.755 0 N-CA-C 110.254 -0.71 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -160.03 146.61 15.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 178.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 60.9 71.68 0.55 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.543 0.687 . . . . 0.0 110.287 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -118.94 149.91 40.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.561 -175.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -83.54 157.63 22.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.683 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -98.2 -6.37 31.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.684 -178.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.458 ' HA ' ' HB2' ' B' ' 58' ' ' ASN . 4.6 m-20 -92.28 3.11 56.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.242 179.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -66.43 116.49 34.57 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.073 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.97 130.29 28.66 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.56 2.173 . . . . 0.0 112.783 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.6 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.1 tt0 -111.15 103.0 11.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.191 177.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 81.8 m-85 -86.39 156.51 20.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.602 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.536 ' OE2' ' HE2' ' B' ' 37' ' ' LYS . 35.0 tt0 -129.24 118.64 22.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.506 -0.77 . . . . 0.0 108.983 175.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -94.29 133.88 33.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.412 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.536 ' HE2' ' OE2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -128.84 145.41 51.21 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 176.382 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.5 ttt -125.68 138.38 53.89 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.442 -178.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.598 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 6.6 tmtm? -142.13 135.12 28.74 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -173.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.443 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 7.7 mpt_? -99.07 133.33 43.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.813 0.339 . . . . 0.0 111.122 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.598 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 45.8 m-85 -118.44 150.79 38.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.619 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -134.39 120.94 20.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.642 177.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.36 26.49 51.54 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.518 -0.849 . . . . 0.0 112.578 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.22 171.81 8.03 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.09 -20.53 65.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.335 0.588 . . . . 0.0 110.391 176.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.6 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 1.0 OUTLIER -126.38 142.01 51.69 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.6 mppt? -101.81 -21.53 14.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.599 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -139.76 130.52 25.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.899 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -116.11 129.73 56.47 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.599 HD11 HD12 ' B' ' 48' ' ' LEU . 2.7 mp -122.06 130.64 74.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.542 HD11 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -116.47 123.59 47.86 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.277 -176.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.7 mp -125.61 103.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.004 -0.543 . . . . 0.0 109.545 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.1 pt-20 -108.38 153.6 23.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.949 0.404 . . . . 0.0 110.191 -178.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -98.18 113.6 25.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.662 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -135.65 93.19 2.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.6 0.714 . . . . 0.0 110.318 178.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.6 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -137.24 167.52 20.47 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.48 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.59 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 11.0 Cg_endo -54.54 -42.32 69.22 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.358 2.039 . . . . 0.0 111.419 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . 0.458 ' HB2' ' HA ' ' B' ' 30' ' ' ASP . 28.1 m-80 -137.38 77.8 1.66 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.618 178.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 4.6 m -75.42 111.87 11.15 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.796 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -132.44 71.26 79.34 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.197 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -72.04 143.64 40.9 Favored 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.133 1.889 . . . . 0.0 110.908 174.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -113.0 -67.64 0.99 Allowed 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.13 -175.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.07 163.76 20.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.191 0.52 . . . . 0.0 110.927 177.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -132.17 127.77 36.59 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.302 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 18.2 m -130.58 78.81 73.35 Favored Pre-proline 0 C--N 1.318 -0.769 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.208 178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.458 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 94.8 Cg_endo -84.54 156.02 12.23 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 122.557 2.171 . . . . 0.0 112.492 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.8 p -162.11 139.67 8.56 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.112 178.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.446 ' HB2' HD23 ' B' ' 75' ' ' LEU . 60.7 t80 -104.34 128.05 52.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.436 -178.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.551 HD21 ' HB2' ' B' ' 72' ' ' GLU . 0.1 OUTLIER -105.37 132.59 51.37 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -79.61 -25.74 41.4 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.499 -178.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.66 -51.11 66.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.143 0.496 . . . . 0.0 110.841 -175.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.551 ' HB2' HD21 ' B' ' 69' ' ' ASN . 2.4 mt-10 -104.68 -3.39 23.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.15 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' B' ' 69' ' ' ASN . 2.3 p-10 57.74 43.67 21.65 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 122.088 0.947 . . . . 0.0 110.909 173.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' B' ' 72' ' ' GLU . 62.4 mt -119.84 134.28 63.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.14 -177.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.446 HD23 ' HB2' ' B' ' 68' ' ' TYR . 2.6 tm? -105.48 103.3 12.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.971 178.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -91.43 146.56 23.7 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -179.54 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 40.3 mm -99.01 -51.86 9.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.481 -173.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.445 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.9 m-20 -155.67 179.48 9.15 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.31 33.92 1.12 Allowed Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.381 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . 0.445 ' H ' ' C ' ' B' ' 78' ' ' ASN . 31.5 mmtp -124.12 -42.04 2.17 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.428 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.7 OUTLIER -155.23 153.39 30.58 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.802 -178.191 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.401 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 54.9 p -127.69 141.76 51.52 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.231 179.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.9 mm -104.67 104.65 46.78 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-O 120.815 0.34 . . . . 0.0 110.63 -178.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -81.05 132.9 8.65 Favored 'Trans proline' 0 N--CA 1.453 -0.867 0 C-N-CA 122.213 1.942 . . . . 0.0 111.942 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -95.58 147.36 32.88 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.971 -0.558 . . . . 0.0 109.892 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.48 ' HG2' HD12 ' B' ' 89' ' ' ILE . 34.8 Cg_endo -66.11 139.02 54.15 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.188 1.926 . . . . 0.0 111.396 176.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.02 -5.13 39.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.553 -176.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -75.89 -20.09 58.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.842 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.48 HD12 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -111.67 137.26 45.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.446 -176.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 6.4 p -88.57 122.71 40.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 47.5 t -122.55 136.09 60.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.908 -175.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.742 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.54 164.15 30.99 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.763 176.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.466 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.04 -22.37 66.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.144 0.497 . . . . 0.0 111.197 -176.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -11.88 57.65 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.867 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.742 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 15.5 t70 -105.18 -25.06 12.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.511 -177.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.414 HG22 HG13 ' B' ' 98' ' ' ILE . 72.0 mt -75.66 119.13 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.433 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.408 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 11.6 mmmm -113.23 100.34 8.5 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.753 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.448 HD12 ' HB ' ' A' ' 8' ' ' ILE . 45.3 mt -104.44 118.43 51.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-O 121.026 0.441 . . . . 0.0 111.211 -178.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -129.8 119.02 22.7 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.574 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.429 ' HB2' HD13 ' B' ' 107' ' ' LEU . 85.2 t60 -101.57 121.49 42.08 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.81 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.543 HG22 ' H ' ' B' ' 104' ' ' GLU . 76.9 mt -101.86 116.2 45.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 174.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.506 ' HD3' ' OE1' ' A' ' 12' ' ' GLU . 21.4 mtm180 -81.2 -39.77 24.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.647 -174.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.41 -32.54 71.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.337 0.589 . . . . 0.0 110.901 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.543 ' H ' HG22 ' B' ' 101' ' ' ILE . 32.6 tt0 -101.36 -5.47 25.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.129 -178.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 34.5 mtm180 51.03 37.77 18.76 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.766 -1.107 . . . . 0.0 111.779 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.411 HG23 ' HB3' ' B' ' 53' ' ' GLU . 45.7 m -128.41 139.68 52.23 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.797 -175.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' B' ' 100' ' ' HIS . 52.5 tp -111.19 117.19 32.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.28 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.542 ' CE2' HD11 ' B' ' 51' ' ' LEU . 44.0 m-85 -98.62 124.5 43.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.322 -178.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.473 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 45.0 mm -113.11 117.01 54.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.108 178.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 72.8 m-85 -118.71 127.66 53.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 177.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.6 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 64.1 mt . . . . . 0 C--O 1.248 1.013 0 CA-C-O 119.035 -0.507 . . . . 0.0 109.778 178.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.866 -0.494 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -63.81 -66.0 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.581 2.187 . . . . 0.0 111.404 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.571 ' HA ' ' HB2' ' B' ' 71' ' ' ALA . 20.9 m-70 -128.95 -79.96 0.57 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 175.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 39.3 tpp 65.27 124.15 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 122.066 0.936 . . . . 0.0 112.075 179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 21.2 p -139.81 129.63 24.67 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.03 179.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.45 HG21 ' HB2' ' B' ' 93' ' ' ALA . 16.4 m -116.76 136.61 53.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.448 -178.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -86.8 138.11 31.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -176.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.489 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.13 121.11 42.62 Favored Pre-proline 0 C--N 1.319 -0.751 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.351 -179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.91 135.54 23.54 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 122.58 2.187 . . . . 0.0 112.482 178.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.495 HG13 HG22 ' B' ' 98' ' ' ILE . 26.0 t -98.8 134.75 36.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.982 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.842 HG12 ' HA ' ' B' ' 99' ' ' PHE . 3.6 p -89.6 148.04 4.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.526 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 33.2 mt-10 -115.27 94.22 4.63 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.733 0.778 . . . . 0.0 110.237 170.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.429 HG13 HG22 ' A' ' 11' ' ' VAL . 5.1 m -115.43 -171.75 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.358 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.402 ' O ' HG12 ' B' ' 101' ' ' ILE . 6.4 m-20 -99.19 -30.75 12.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -153.82 178.05 10.33 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.406 176.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.45 HD23 ' HB2' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -84.6 149.36 54.18 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.393 173.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.442 ' HG2' ' CE1' ' A' ' 20' ' ' TYR . 39.7 Cg_endo -68.94 165.21 30.76 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.046 1.831 . . . . 0.0 111.472 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.05 135.41 56.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.097 0.475 . . . . 0.0 110.869 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.46 -5.27 29.77 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.815 -174.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.442 ' CE1' ' HG2' ' A' ' 17' ' ' PRO . 65.0 m-85 -106.35 176.8 5.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.931 0.396 . . . . 0.0 111.318 177.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -131.54 97.35 4.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.538 -178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.591 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 64.3 ttp85 -93.82 145.98 24.21 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.501 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.6 t . . . . . 0 C--O 1.245 0.866 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 178.997 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.48 0.721 0 N-CA-C 111.44 -0.254 . . . . 0.0 111.44 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -91.46 -62.39 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 58.38 -158.48 0.29 Allowed 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.791 0.682 . . . . 0.0 111.293 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.423 ' H ' ' CD ' ' B' ' 27' ' ' GLN . 0.3 OUTLIER -83.29 164.93 19.76 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 175.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.03 153.44 43.78 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.445 0.641 . . . . 0.0 111.021 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' B' ' 58' ' ' ASN . 11.5 pt-20 -85.21 -20.43 30.17 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.361 -177.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.587 ' HA ' ' O ' ' B' ' 58' ' ' ASN . 5.1 p-10 -87.05 -2.48 58.66 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.163 -178.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.76 119.01 50.7 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.437 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.95 129.12 16.86 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.413 2.075 . . . . 0.0 111.645 178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.607 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 33.7 tt0 -102.55 98.09 8.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 179.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.502 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.9 m-85 -83.11 148.17 27.66 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.753 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -120.37 114.66 22.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.283 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 82.8 t -94.62 125.22 47.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.503 -178.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.487 ' HB2' ' HB2' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -123.23 142.49 50.87 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.204 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.577 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.5 OUTLIER -127.4 137.83 52.84 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 121.169 -0.212 . . . . 0.0 110.552 -174.504 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.504 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 9.5 tmtt? -145.58 132.9 20.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.653 0.263 . . . . 0.0 110.362 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.504 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.2 OUTLIER -93.09 139.56 30.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.358 -177.835 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.432 ' CE2' ' HE1' ' B' ' 46' ' ' TYR . 23.9 m-85 -121.49 167.67 12.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.31 176.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -156.4 112.0 2.95 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.075 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 97.66 16.81 32.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.056 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.09 172.09 7.27 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.7 -18.91 63.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.114 0.483 . . . . 0.0 110.87 178.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.586 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 2.4 p90 -130.69 147.85 52.41 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.508 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.43 -20.07 14.19 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.203 0.525 . . . . 0.0 109.806 -177.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.577 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.1 OUTLIER -136.23 133.52 37.13 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.498 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.7 ttp180 -115.83 115.6 26.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.405 176.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.597 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.5 mp -114.64 131.86 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.572 HD11 ' CD2' ' B' ' 108' ' ' TYR . 4.2 mm? -115.23 122.91 47.44 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.989 -178.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.63 103.46 11.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 176.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.502 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 13.8 pt-20 -113.05 153.42 28.16 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.072 0.463 . . . . 0.0 110.477 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.435 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -96.37 110.05 22.46 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.885 -177.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -135.67 93.17 2.91 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.509 0.671 . . . . 0.0 110.775 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.607 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.29 163.81 47.38 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.26 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.544 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 18.0 Cg_endo -57.53 -43.1 54.11 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.29 1.993 . . . . 0.0 111.973 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' B' ' 30' ' ' ASP . 29.0 m-80 -136.72 68.94 1.42 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.974 -178.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 7.5 m -71.08 121.6 18.55 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.208 -175.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -133.04 73.09 75.78 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.026 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.69 145.62 95.07 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.78 2.32 . . . . 0.0 112.043 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -92.73 -59.36 2.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.046 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 12.4 ptt180 -163.43 178.87 7.72 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.546 -176.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -134.44 117.34 16.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.642 174.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 38.7 m -133.55 78.8 61.41 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-O 121.009 0.433 . . . . 0.0 110.104 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.592 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 93.2 Cg_endo -82.09 150.89 15.93 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.569 2.179 . . . . 0.0 112.193 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 15.1 m -158.33 144.71 17.31 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.125 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.463 ' CZ ' HG13 ' B' ' 91' ' ' VAL . 45.2 t80 -102.71 118.3 36.54 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.615 -178.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.423 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.1 p-10 -101.18 115.84 31.42 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.753 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -63.8 -26.26 68.55 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.619 -178.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.571 ' HB2' ' HA ' ' A' ' 3' ' ' HIS . . . -52.0 -49.13 63.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.784 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.585 ' O ' HG13 ' B' ' 74' ' ' ILE . 11.2 mt-10 -112.08 2.44 16.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.16 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 47.69 46.02 18.12 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.54 1.15 . . . . 0.0 110.811 -174.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.585 HG13 ' O ' ' B' ' 72' ' ' GLU . 84.7 mt -120.85 137.09 55.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.097 -177.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.434 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.3 tm? -100.11 100.71 11.61 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 177.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.592 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.4 OUTLIER -87.82 137.61 32.19 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.597 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.2 mm -89.79 -49.11 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.403 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -151.59 -177.57 6.18 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.55 0.96 54.03 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.238 -0.982 . . . . 0.0 111.918 176.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -94.25 -34.77 12.74 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.81 0.338 . . . . 0.0 110.411 -176.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.4 OUTLIER -157.0 152.39 26.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.802 178.041 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' B' ' 84' ' ' PRO . 35.8 p -128.45 150.0 50.33 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.105 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -107.77 98.82 26.65 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-O 120.821 0.344 . . . . 0.0 110.553 -179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.541 ' HA ' HG12 ' B' ' 74' ' ' ILE . 14.5 Cg_exo -70.53 135.95 29.81 Favored 'Trans proline' 0 CA--C 1.515 -0.429 0 C-N-CA 122.558 2.172 . . . . 0.0 112.127 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.03 147.84 35.17 Favored Pre-proline 0 C--N 1.318 -0.79 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.257 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.457 ' HG2' HD12 ' B' ' 89' ' ' ILE . 36.8 Cg_endo -66.96 139.27 50.8 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.251 1.967 . . . . 0.0 111.64 178.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -7.72 52.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.683 -176.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -80.41 -13.74 58.89 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.636 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.457 HD12 ' HG2' ' B' ' 86' ' ' PRO . 61.1 mt -113.9 133.44 59.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.058 -174.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 8.8 p -83.94 125.57 40.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.464 176.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . 0.463 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.3 p -137.23 137.45 46.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.24 0.543 . . . . 0.0 111.447 -174.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.637 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -139.73 165.62 26.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.618 177.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.45 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -59.54 -25.89 64.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.291 0.567 . . . . 0.0 111.237 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.95 -12.98 59.29 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.02 -178.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.637 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 23.0 t0 -106.01 -22.57 12.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.628 0.728 . . . . 0.0 109.639 -177.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 75.4 mt -76.39 117.11 20.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.44 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.9 mmmt -110.96 109.45 19.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.157 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.495 HG22 HG13 ' A' ' 10' ' ' VAL . 50.8 mt -113.48 118.01 57.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 121.206 0.526 . . . . 0.0 111.401 -178.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.842 ' HA ' HG12 ' A' ' 11' ' ' VAL . 73.7 m-85 -128.06 117.67 22.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.475 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.526 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 20.6 t-80 -98.96 110.08 22.74 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.027 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.673 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.7 mp -91.82 109.05 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -81.08 -17.74 49.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.593 -174.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -70.07 -47.61 61.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.14 0.495 . . . . 0.0 110.076 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.673 ' H ' HG22 ' B' ' 101' ' ' ILE . 18.5 mm-40 -86.71 -1.8 58.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.256 177.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 53.02 38.5 27.46 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.576 -176.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.416 HG23 ' HB3' ' B' ' 53' ' ' GLU . 40.1 m -125.88 128.12 47.09 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.099 0.476 . . . . 0.0 110.956 -173.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . 0.425 HD11 ' CG2' ' B' ' 98' ' ' ILE . 45.1 tp -98.9 112.57 24.63 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.907 177.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.591 ' CE2' ' HG3' ' A' ' 22' ' ' ARG . 61.2 m-85 -91.99 123.13 35.12 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.952 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.597 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.7 mm -112.12 124.9 69.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.961 177.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.496 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 87.8 m-85 -126.9 123.73 37.91 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.586 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 70.0 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.457 -0.783 . . . . 0.0 110.109 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.623 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.86 129.84 13.87 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.793 2.329 . . . . 0.0 112.135 -178.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -56.04 -32.79 64.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.32 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.403 ' HG3' ' CD1' ' B' ' 70' ' ' PHE . 43.9 tpp -148.33 131.17 16.1 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.166 0.507 . . . . 0.0 110.33 174.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p -152.49 137.69 17.43 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.795 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.504 HG21 ' HB2' ' B' ' 93' ' ' ALA . 21.6 m -130.18 148.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.886 0.374 . . . . 0.0 110.569 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.484 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -92.3 138.96 31.08 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 7.6 mm -107.73 122.95 39.34 Favored Pre-proline 0 C--N 1.32 -0.677 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.467 -176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.11 129.02 15.55 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.293 1.995 . . . . 0.0 112.015 177.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.476 HG23 HG22 ' B' ' 98' ' ' ILE . 2.4 p -104.67 135.3 43.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.311 0.577 . . . . 0.0 110.869 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' B' ' 99' ' ' PHE . 3.5 p -86.53 148.8 4.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.632 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 44.2 mt-10 -115.23 93.75 4.43 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.565 0.698 . . . . 0.0 110.047 170.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 12.6 m -116.06 -173.44 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.938 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.54 -22.48 16.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.569 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -169.98 172.95 6.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.395 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -76.13 150.53 83.22 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.38 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 51.1 Cg_endo -71.64 172.91 13.42 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 121.948 1.765 . . . . 0.0 111.968 176.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -53.52 138.53 33.73 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.315 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.29 -9.61 53.89 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.64 179.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 60.7 m-85 -99.92 143.07 30.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.202 0.525 . . . . 0.0 111.969 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -96.2 95.58 8.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.619 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.485 ' HB2' HD23 ' A' ' 16' ' ' LEU . 18.2 ttt180 -92.1 149.06 21.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.702 -175.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.408 ' H ' ' HE2' ' B' ' 108' ' ' TYR . 48.3 m . . . . . 0 C--O 1.251 1.156 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.261 173.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.474 0.338 0 N-CA-C 110.479 -0.623 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 7.1 p-80 -76.47 -21.62 55.62 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.069 0.461 . . . . 0.0 110.513 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -96.33 128.54 43.34 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -102.0 144.87 30.07 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.21 -177.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 66.55 157.49 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 O-C-N 124.275 0.985 . . . . 0.0 112.999 177.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -108.92 2.14 21.24 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.998 177.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -84.19 -13.75 51.94 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.392 176.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 51.8 t -77.2 117.28 64.15 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.535 -170.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.506 ' HA ' ' HB3' ' B' ' 59' ' ' SER . 41.1 Cg_endo -70.38 130.04 17.93 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.475 2.116 . . . . 0.0 112.304 177.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.431 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 36.8 tt0 -90.8 97.92 11.47 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.361 177.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.481 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.5 m-85 -87.56 153.64 21.24 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.496 176.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -125.89 118.18 24.91 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 176.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 62.0 t -95.77 126.87 48.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.869 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.58 119.12 26.29 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.665 ' HG2' HD11 ' B' ' 48' ' ' LEU . 1.2 ttt -101.85 139.64 37.22 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -144.98 131.65 19.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.769 0.319 . . . . 0.0 110.621 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.6 mmt180 -87.99 143.12 27.27 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.511 0.672 . . . . 0.0 112.586 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -131.17 152.48 50.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.074 176.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -140.97 116.3 10.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.292 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 87.98 16.95 58.72 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.148 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.27 172.06 7.03 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.758 0.313 . . . . 0.0 110.721 -177.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.02 -3.54 16.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.124 0.488 . . . . 0.0 110.864 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.461 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -147.42 140.21 24.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.781 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.523 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 3.1 mppt? -94.28 -23.29 17.91 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.268 0.556 . . . . 0.0 109.646 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.665 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.2 OUTLIER -135.74 134.0 38.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.16 179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 -116.54 123.01 46.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.476 174.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' B' ' 109' ' ' ILE . 2.0 mp -119.7 127.83 75.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.514 HD11 ' CE2' ' B' ' 108' ' ' TYR . 1.3 mm? -113.01 118.48 34.94 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -121.81 102.88 12.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 176.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 15.4 pt-20 -108.79 153.95 22.76 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.353 -178.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -97.67 115.34 27.75 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 176.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ptmm? -137.55 91.41 2.59 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.386 176.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.518 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -136.63 153.92 76.26 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.562 172.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -62.5 -38.34 52.74 Favored 'Trans proline' 0 CA--C 1.519 -0.227 0 C-N-CA 122.845 2.363 . . . . 0.0 110.668 172.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -135.48 99.98 4.37 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 114.749 -1.114 . . . . 0.0 108.74 -177.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.518 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 7.5 p -150.25 129.24 12.6 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.708 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' B' ' 60' ' ' LYS . 18.6 ptpt -121.56 78.69 37.77 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.355 -177.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.21 137.63 52.66 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.286 1.991 . . . . 0.0 112.001 176.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -104.14 -59.96 1.65 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.707 -176.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -161.52 171.65 17.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.335 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -124.96 133.89 52.84 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.194 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 49.9 m -134.9 78.96 53.02 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 173.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 64.3 Cg_endo -78.93 150.27 23.41 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.609 2.206 . . . . 0.0 112.255 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 11.4 m -155.86 147.47 22.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.384 -178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.46 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.0 t80 -109.8 118.58 36.87 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.709 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.434 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.4 p-10 -99.14 113.2 25.31 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.482 175.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . 0.403 ' CD1' ' HG3' ' A' ' 4' ' ' MET . 58.2 m-85 -62.82 -32.66 73.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.907 -175.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.92 72.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.959 -176.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.455 ' O ' HG13 ' B' ' 74' ' ' ILE . 12.1 mm-40 -112.17 1.06 16.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.198 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 47.47 46.55 17.43 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 124.521 1.138 . . . . 0.0 111.487 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.455 HG13 ' O ' ' B' ' 72' ' ' GLU . 59.3 mt -120.5 136.99 55.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.155 -178.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.46 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -103.36 101.31 11.22 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.431 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -88.76 143.52 26.86 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -178.575 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 48.1 mm -96.11 -60.89 2.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.271 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.32 -171.56 3.87 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.72 2.27 41.23 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.105 176.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -85.63 -45.78 11.39 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.506 0.67 . . . . 0.0 109.344 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.446 ' O ' HD12 ' B' ' 81' ' ' LEU . 0.6 OUTLIER -159.32 153.45 23.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.134 -176.108 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 26.7 p -124.49 148.43 47.71 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.799 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.2 mm -105.73 102.07 36.36 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.804 0.335 . . . . 0.0 110.456 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.453 ' HA ' HG12 ' B' ' 74' ' ' ILE . 57.6 Cg_endo -74.22 131.82 15.75 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.081 1.854 . . . . 0.0 111.708 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 62.5 mt -102.28 146.76 32.9 Favored Pre-proline 0 C--N 1.318 -0.784 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.236 -175.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -69.05 139.86 43.78 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.194 1.929 . . . . 0.0 111.673 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.26 -3.11 24.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.468 -176.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -81.26 -13.28 58.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 61.2 mt -112.52 134.72 54.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.684 -177.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 95.3 t -87.52 109.23 19.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . 0.447 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -119.95 135.79 59.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.255 0.55 . . . . 0.0 111.11 -173.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.487 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -139.82 165.82 26.27 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.815 179.906 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.504 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.89 -20.3 63.59 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.491 0.494 . . . . 0.0 111.682 -176.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.7 -14.12 46.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.141 -179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.487 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 28.7 t0 -105.78 -23.97 12.6 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.723 0.773 . . . . 0.0 109.768 -177.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 76.5 mt -72.09 117.08 14.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.387 177.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 25.7 mmmt -110.91 108.27 18.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.091 178.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.476 HG22 HG23 ' A' ' 10' ' ' VAL . 54.3 mt -112.74 119.74 61.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.203 -177.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.833 ' HA ' HG12 ' A' ' 11' ' ' VAL . 75.7 m-85 -128.71 117.01 20.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.87 -178.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.514 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 17.4 t-80 -98.55 113.83 26.01 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.905 177.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.605 HG22 ' H ' ' B' ' 104' ' ' GLU . 2.8 mp -91.11 126.07 43.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 172.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 75.1 mtm180 -80.72 -45.43 17.11 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.354 -173.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -62.74 -47.5 83.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -177.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.605 ' H ' HG22 ' B' ' 101' ' ' ILE . 45.2 mm-40 -81.62 -1.05 45.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.146 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 104' ' ' GLU . 12.5 ptm180 44.12 41.79 4.44 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.166 0.916 . . . . 0.0 111.42 -177.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -127.46 141.77 51.58 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.834 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.76 118.66 35.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.41 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.514 ' CE2' HD11 ' B' ' 51' ' ' LEU . 38.4 m-85 -98.62 131.48 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.36 -179.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 38.6 mm -119.74 123.01 70.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.068 176.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.416 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 89.1 m-85 -123.53 130.39 52.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 176.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.461 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.915 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.856 0 N-CA-C 112.059 -0.416 . . . . 0.0 112.059 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.77 -1.56 10.96 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.248 2.632 . . . . 0.0 113.146 -175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -122.21 30.36 6.61 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.067 0.46 . . . . 0.0 110.179 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 75.2 mtp -111.38 177.05 4.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.201 -179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.9 p -140.79 131.68 25.98 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.628 174.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.47 HG21 ' HB2' ' B' ' 93' ' ' ALA . 28.0 m -128.32 152.24 36.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.552 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.6 OUTLIER -93.05 136.88 32.91 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.4 mm -106.5 124.11 36.7 Favored Pre-proline 0 C--N 1.319 -0.745 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.186 -178.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.3 136.87 32.6 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.403 2.069 . . . . 0.0 112.067 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.504 HG23 HG22 ' B' ' 98' ' ' ILE . 2.5 p -114.3 134.11 58.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.267 0.556 . . . . 0.0 110.744 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.825 HG12 ' HA ' ' B' ' 99' ' ' PHE . 4.1 p -89.09 149.12 4.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.664 -179.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.52 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 47.5 mt-10 -107.59 94.92 5.34 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.951 0.405 . . . . 0.0 109.959 169.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 9.0 m -117.28 -176.11 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.586 -178.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -104.07 -29.68 10.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 176.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -151.93 166.46 31.42 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.883 -1.053 . . . . 0.0 110.01 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.403 HD22 ' H ' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -84.04 151.33 60.21 Favored Pre-proline 0 N--CA 1.444 -0.736 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.879 177.402 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -53.69 167.57 0.97 Allowed 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 123.523 2.816 . . . . 0.0 113.588 175.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -63.21 130.14 43.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.639 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 107.6 -9.75 38.16 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.797 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.1 164.1 13.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 111.561 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -103.57 153.83 20.16 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.373 175.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.9 ttp85 -145.22 138.82 26.75 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 171.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 C--O 1.252 1.194 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.693 -176.175 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo . . . . . 0 N--CA 1.478 0.594 0 N-CA-C 110.306 -0.69 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -81.67 121.51 26.46 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.211 0.529 . . . . 0.0 110.186 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -138.82 -166.47 2.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.41 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -84.56 142.37 30.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.912 0.387 . . . . 0.0 110.322 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.35 153.45 19.9 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.174 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -112.14 -16.86 12.94 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.208 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.427 ' HB2' ' HE2' ' B' ' 60' ' ' LYS . 11.5 p-10 -100.34 -0.45 38.31 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.587 178.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 8.3 p -70.15 124.61 91.07 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.971 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -63.62 128.77 23.11 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.487 2.125 . . . . 0.0 111.685 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.656 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 31.0 tt0 -105.89 100.41 9.97 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 121.472 0.653 . . . . 0.0 109.41 178.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.433 ' HB2' HD21 ' B' ' 81' ' ' LEU . 90.3 m-85 -85.23 146.14 27.22 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.771 179.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.425 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 29.7 tt0 -119.16 108.5 14.74 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 176.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.4 p -96.98 137.25 25.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.48 -175.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -128.51 146.28 50.87 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.155 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.476 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -126.13 143.08 51.26 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.519 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 7.8 tmtm? -147.03 137.99 23.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 -176.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.509 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 8.0 mpt_? -99.08 139.48 34.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.02 0.438 . . . . 0.0 110.725 -178.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.519 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 44.8 m-85 -127.02 157.07 40.56 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.222 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.444 ' NZ ' ' HB2' ' B' ' 42' ' ' LYS . 0.0 OUTLIER -156.75 110.18 2.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.654 175.181 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 113.98 -1.34 24.27 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -107.14 171.83 7.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.567 -0.316 . . . . 0.0 110.328 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.86 -18.48 64.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.201 0.524 . . . . 0.0 110.779 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.593 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.5 OUTLIER -126.39 143.04 51.31 Favored 'General case' 0 N--CA 1.444 -0.73 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.805 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.513 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.9 mppt? -103.54 -17.48 15.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.164 0.507 . . . . 0.0 109.832 -176.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.626 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -141.21 132.74 26.97 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.157 179.306 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.623 ' HG3' ' CE1' ' B' ' 110' ' ' TYR . 19.3 ttp180 -115.65 129.27 56.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.794 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.626 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -125.82 127.13 71.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 176.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.514 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 0.9 OUTLIER -115.32 119.55 36.68 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.195 -177.032 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.16 104.21 14.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.43 ' HB3' HG23 ' B' ' 106' ' ' THR . 12.3 pt-20 -107.78 152.22 24.66 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' B' ' 59' ' ' SER . 1.7 t-20 -103.83 116.12 31.71 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.898 0.38 . . . . 0.0 110.661 -178.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -137.72 93.27 2.77 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.694 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.656 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.36 163.99 46.06 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.253 176.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.53 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 16.2 Cg_endo -57.24 -46.43 28.32 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.25 1.967 . . . . 0.0 111.909 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' B' ' 30' ' ' ASP . 29.3 m-80 -135.94 61.63 1.64 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.305 -176.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.467 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 13.4 m -62.21 120.96 11.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.429 -177.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.427 ' HE2' ' HB2' ' B' ' 30' ' ' ASP . 45.6 mtmt -125.51 72.92 67.87 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.013 174.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -76.5 139.61 20.69 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.107 1.872 . . . . 0.0 111.246 172.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . 0.52 ' HB3' ' HE ' ' B' ' 63' ' ' ARG . 6.7 m-20 -84.5 -66.78 0.86 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.429 -178.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.52 ' HE ' ' HB3' ' B' ' 62' ' ' ASP . 0.8 OUTLIER -160.75 166.82 28.04 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.996 -178.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -111.6 127.88 55.87 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.44 -178.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 31.3 p -135.12 79.54 50.04 Favored Pre-proline 0 C--N 1.317 -0.808 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.814 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.498 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.9 Cg_endo -79.44 145.83 18.97 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.379 2.052 . . . . 0.0 112.338 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.2 m -153.42 147.74 25.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.45 -177.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.495 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.5 t80 -113.01 127.64 56.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.081 0.467 . . . . 0.0 111.043 -176.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.472 HD21 ' HB ' ' B' ' 74' ' ' ILE . 2.2 p-10 -105.33 116.46 31.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.172 174.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -65.9 -32.89 74.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.608 -176.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.32 -53.3 55.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.535 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.527 ' O ' HG13 ' B' ' 74' ' ' ILE . 5.7 mt-10 -105.74 7.96 32.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.713 -177.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 48.72 42.37 19.5 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.128 0.971 . . . . 0.0 111.752 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.527 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.6 mt -116.04 137.89 48.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.489 -178.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.495 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.4 tm? -108.14 107.02 17.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.498 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -94.07 136.36 34.44 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 -178.211 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 34.5 mm -90.98 -47.93 14.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.107 -175.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -159.2 175.61 13.23 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 -173.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.24 9.65 12.73 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.296 174.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -99.54 -37.69 9.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.433 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -162.47 153.69 17.77 Favored 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.492 0.663 . . . . 0.0 112.003 179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 39.9 t -129.42 147.89 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.909 177.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mm -111.39 106.67 57.12 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.999 0.428 . . . . 0.0 110.966 -175.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -74.94 134.36 17.82 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.155 1.903 . . . . 0.0 111.67 177.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 74.6 mt -102.37 154.95 37.07 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.684 -175.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.469 ' HG2' HD12 ' B' ' 89' ' ' ILE . 40.1 Cg_endo -68.95 141.88 49.88 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.229 1.953 . . . . 0.0 111.865 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.92 -3.14 46.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.486 -176.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -86.62 -9.36 56.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.287 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.469 HD12 ' HG2' ' B' ' 86' ' ' PRO . 61.2 mt -114.04 134.19 57.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.478 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -87.25 111.66 22.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 58.6 t -116.05 133.7 61.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.145 0.498 . . . . 0.0 111.038 -173.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.478 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.36 160.75 39.47 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.405 177.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.47 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.97 -20.62 64.04 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.173 0.511 . . . . 0.0 111.588 -176.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.06 -12.99 56.66 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.249 -178.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.478 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 26.9 t70 -110.07 -24.31 10.83 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.493 0.663 . . . . 0.0 109.812 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 86.7 mt -69.69 118.35 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.168 176.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -112.98 107.38 15.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.9 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.504 HG22 HG23 ' A' ' 10' ' ' VAL . 56.8 mt -110.28 121.76 63.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 111.428 -178.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.825 ' HA ' HG12 ' A' ' 11' ' ' VAL . 78.8 m-85 -129.12 118.84 23.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.199 -179.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.52 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 23.8 t-80 -104.44 108.64 20.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.136 0.493 . . . . 0.0 110.41 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.638 HG22 ' H ' ' B' ' 104' ' ' GLU . 66.2 mt -86.73 98.61 7.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.439 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.434 ' HD2' ' OE2' ' A' ' 12' ' ' GLU . 14.2 ptm180 -74.8 -10.96 60.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.508 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -69.39 -43.15 74.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.386 175.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.638 ' H ' HG22 ' B' ' 101' ' ' ILE . 30.0 mm-40 -99.9 -6.86 26.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.454 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 61.35 36.96 17.3 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.502 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.43 HG23 ' HB3' ' B' ' 53' ' ' GLU . 19.4 m -123.26 142.26 51.11 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.373 -176.045 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.15 121.59 44.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.161 -178.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.529 ' CE1' HD12 ' B' ' 101' ' ' ILE . 17.7 m-85 -106.17 130.19 54.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.163 -178.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.575 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.4 mm -118.11 124.43 73.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.952 176.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.623 ' CE1' ' HG3' ' B' ' 49' ' ' ARG . 98.9 m-85 -128.62 125.02 37.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.908 0.385 . . . . 0.0 110.288 177.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.593 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 56.2 mt . . . . . 0 C--O 1.246 0.883 0 CA-C-O 118.648 -0.692 . . . . 0.0 109.718 -179.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.886 0 N-CA-C 112.005 -0.438 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.86 -58.98 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.857 2.371 . . . . 0.0 112.222 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -72.94 146.4 46.1 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -71.57 167.32 19.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.517 0.675 . . . . 0.0 112.249 -172.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.8 p -136.45 128.47 29.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.036 174.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.511 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.6 m -121.38 138.79 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.047 0.451 . . . . 0.0 111.659 -173.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.437 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -85.23 138.27 32.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.843 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.573 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.9 mm -110.06 117.44 51.81 Favored Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -177.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.75 128.28 17.68 Favored 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.427 2.085 . . . . 0.0 112.38 -179.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 43.5 t -91.78 131.38 39.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.665 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.8 HG12 ' HA ' ' B' ' 99' ' ' PHE . 2.3 p -87.08 147.57 5.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 173.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.573 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 37.0 mt-10 -115.29 93.98 4.53 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 119.705 -0.798 . . . . 0.0 109.682 168.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.418 HG13 HG22 ' A' ' 11' ' ' VAL . 6.9 m -110.92 -179.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.637 -176.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -86.25 -32.63 21.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.527 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.7 pt-20 -170.48 172.05 6.19 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.678 177.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.415 ' H ' HD22 ' A' ' 16' ' ' LEU . 1.0 OUTLIER -76.7 144.08 72.64 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-O 120.542 0.21 . . . . 0.0 110.45 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.411 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 40.0 Cg_endo -68.08 172.53 10.78 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.278 1.986 . . . . 0.0 111.955 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -57.05 133.64 55.14 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.488 -177.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.25 -11.31 31.25 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.245 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 17' ' ' PRO . 63.4 m-85 -97.58 159.49 14.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.013 0.435 . . . . 0.0 111.472 179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -114.81 95.23 5.12 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.792 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.6 ttp85 -87.44 148.34 25.02 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.061 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 C--O 1.247 0.935 0 O-C-N 123.663 0.602 . . . . 0.0 111.387 -179.695 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo . . . . . 0 N--CA 1.475 0.439 0 N-CA-C 110.623 -0.568 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -140.42 84.98 1.98 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.876 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -86.75 -156.47 0.32 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.548 ' NE2' ' H ' ' B' ' 27' ' ' GLN . 0.0 OUTLIER -60.21 141.73 55.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.981 0.419 . . . . 0.0 110.023 174.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -99.6 157.43 16.46 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.833 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -101.94 -18.84 15.5 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.655 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -92.32 31.03 1.36 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.146 0.498 . . . . 0.0 110.269 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 93.4 t -90.5 111.11 45.64 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.807 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -69.83 129.29 17.27 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 121.837 1.691 . . . . 0.0 111.063 175.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.649 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 34.2 tt0 -102.69 102.57 12.76 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.417 0.627 . . . . 0.0 109.648 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 85.2 m-85 -86.89 138.58 31.43 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.487 175.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.45 ' HG2' ' HE2' ' B' ' 37' ' ' LYS . 22.8 tt0 -118.75 110.04 16.79 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 2.1 p -97.53 131.71 43.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.358 -174.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.45 ' HE2' ' HG2' ' B' ' 35' ' ' GLU . 0.1 OUTLIER -124.0 132.34 53.69 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.509 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.536 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -113.79 143.24 44.98 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.782 -176.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.525 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 7.0 tmtm? -149.47 135.49 18.88 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.12 -0.232 . . . . 0.0 110.473 -176.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.525 ' N ' ' HD3' ' B' ' 39' ' ' LYS . 0.7 OUTLIER -92.28 128.98 38.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.009 0.433 . . . . 0.0 111.017 178.419 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.481 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 11.3 m-85 -114.56 138.98 49.97 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.805 176.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -138.55 106.61 5.72 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.164 0.506 . . . . 0.0 109.719 176.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 122.19 2.84 9.93 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.741 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -114.6 171.63 7.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.76 -21.06 65.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.341 0.591 . . . . 0.0 110.551 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.674 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.8 p90 -119.28 141.65 48.78 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.307 -0.861 . . . . 0.0 108.789 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.493 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.6 mppt? -105.42 -15.39 15.03 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.454 0.645 . . . . 0.0 109.81 -175.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.654 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.11 130.42 28.99 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.889 177.503 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 17.8 ttp180 -119.47 123.5 44.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.892 177.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.654 HD11 HD12 ' B' ' 48' ' ' LEU . 1.9 mp -120.54 127.21 75.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.524 ' O ' ' HA ' ' B' ' 36' ' ' VAL . 2.5 mm? -110.1 112.27 24.15 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.046 -178.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -120.02 103.88 14.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.458 ' HB3' HG23 ' B' ' 106' ' ' THR . 15.6 pt-20 -109.58 153.3 24.36 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.633 -178.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.405 ' HA ' HD22 ' B' ' 54' ' ' ASN . 2.3 t-20 -95.56 108.12 20.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.723 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -135.39 92.37 2.84 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.41 0.624 . . . . 0.0 110.255 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.649 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -136.49 156.27 76.52 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.938 176.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -66.12 -32.81 42.49 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.432 2.088 . . . . 0.0 112.676 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -142.48 62.14 1.42 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.22 0.533 . . . . 0.0 110.241 -176.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.516 ' HB2' ' HB3' ' B' ' 56' ' ' ALA . 8.5 t -79.77 151.41 30.37 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.037 -171.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -136.61 83.59 29.96 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.62 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -64.34 147.47 90.85 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 122.63 2.22 . . . . 0.0 111.757 175.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -116.03 -73.65 0.64 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.489 -177.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -161.04 170.42 20.54 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -125.0 119.43 28.68 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.939 0.4 . . . . 0.0 111.021 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 41.5 m -138.67 80.3 26.31 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.863 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.475 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 90.1 Cg_endo -82.92 162.23 15.93 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.87 2.38 . . . . 0.0 112.213 -179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.5 p -162.71 136.49 6.16 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.0 t80 -98.23 115.76 29.04 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.492 -179.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -96.49 114.71 26.39 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.706 176.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -63.66 -25.05 68.04 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.428 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.86 71.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.845 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.474 ' O ' HG13 ' B' ' 74' ' ' ILE . 6.8 mt-10 -112.56 3.91 17.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.358 -178.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . 0.574 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.5 p-10 47.54 45.33 17.51 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.472 1.107 . . . . 0.0 111.469 -174.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.474 HG13 ' O ' ' B' ' 72' ' ' GLU . 64.6 mt -123.17 137.11 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.01 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -107.17 103.72 13.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.435 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.2 OUTLIER -91.43 141.49 28.69 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.732 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . 0.475 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 33.7 mm -95.27 -48.36 12.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.628 -173.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.466 ' C ' ' H ' ' B' ' 80' ' ' LYS . 9.1 t-20 -155.97 171.94 19.23 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.076 -171.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -75.15 38.65 1.15 Allowed Glycine 0 C--O 1.228 -0.228 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 176.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . 0.466 ' H ' ' C ' ' B' ' 78' ' ' ASN . 71.2 mmtt -130.45 -41.1 1.23 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 -179.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -157.95 153.97 27.04 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.205 -175.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.435 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 49.1 p -125.61 145.42 50.15 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.226 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.0 mm -111.55 100.43 47.89 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.973 0.416 . . . . 0.0 110.7 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -71.4 142.82 41.74 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.77 2.313 . . . . 0.0 112.036 177.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -106.21 142.54 25.08 Favored Pre-proline 0 C--N 1.318 -0.783 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.016 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.492 ' HG2' HD12 ' B' ' 89' ' ' ILE . 24.9 Cg_endo -63.45 139.24 69.72 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.242 1.962 . . . . 0.0 111.281 176.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.574 ' NE ' HD21 ' B' ' 73' ' ' ASN . 8.7 mpt_? -74.31 -3.18 28.68 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.259 -174.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -80.58 -19.35 45.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.524 0.678 . . . . 0.0 109.566 178.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.492 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.6 mt -104.1 131.48 52.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.61 -176.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 63.0 t -84.57 110.23 18.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 176.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 1.7 p -120.74 132.44 70.25 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-O 121.468 0.652 . . . . 0.0 111.41 -172.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.544 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -140.81 164.6 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.194 179.144 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.511 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -61.51 -21.28 64.08 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.692 -176.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -81.94 -15.81 52.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.042 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.544 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 19.1 t0 -106.81 -21.91 12.88 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.65 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 82.7 mt -74.79 119.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.267 178.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.497 ' HB3' ' CE1' ' B' ' 99' ' ' PHE . 27.4 mmmt -113.64 106.42 14.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.065 179.045 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.573 HD12 ' HB ' ' A' ' 8' ' ' ILE . 49.8 mt -109.99 121.75 63.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.174 0.511 . . . . 0.0 111.177 -178.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.8 ' HA ' HG12 ' A' ' 11' ' ' VAL . 53.9 m-85 -130.94 124.32 30.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.132 -177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.573 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 26.9 t-80 -106.38 117.03 32.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.039 0.447 . . . . 0.0 110.578 177.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.611 HG22 ' H ' ' B' ' 104' ' ' GLU . 69.0 mt -99.58 104.84 16.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 172.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.49 -21.58 48.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.403 -174.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -68.81 -43.68 75.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.016 0.436 . . . . 0.0 110.496 176.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.611 ' H ' HG22 ' B' ' 101' ' ' ILE . 11.1 mm-40 -87.73 -7.17 57.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.284 0.564 . . . . 0.0 110.088 177.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 57.06 35.87 26.93 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.51 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.458 HG23 ' HB3' ' B' ' 53' ' ' GLU . 33.2 m -124.43 138.49 54.35 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.623 -174.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.76 123.05 48.85 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.603 ' CE1' HD12 ' B' ' 101' ' ' ILE . 19.4 m-85 -105.73 129.59 53.91 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.854 -176.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.582 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 37.2 mm -117.37 119.62 62.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.858 177.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.47 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 83.7 m-85 -122.49 122.7 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 176.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.674 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 68.0 mt . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.902 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.712 0 N-CA-C 112.006 -0.438 . . . . 0.0 112.006 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.75 -10.09 27.06 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.91 2.407 . . . . 0.0 112.848 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.5 m-70 -135.53 29.43 3.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.829 0.347 . . . . 0.0 110.45 177.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 42.9 tpp -108.76 133.36 52.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.889 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 4.2 m -145.45 137.6 25.62 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.992 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' B' ' 93' ' ' ALA . 31.5 m -123.52 150.0 27.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.027 0.441 . . . . 0.0 110.721 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.56 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -91.4 139.66 30.51 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.762 179.099 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.474 ' HB ' HD12 ' B' ' 98' ' ' ILE . 6.0 mm -110.42 119.54 46.48 Favored Pre-proline 0 C--N 1.323 -0.56 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.137 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.47 128.44 17.24 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.099 1.866 . . . . 0.0 112.207 177.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 HG22 ' B' ' 98' ' ' ILE . 2.6 p -105.21 135.48 43.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.811 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.679 HG21 ' HD1' ' B' ' 99' ' ' PHE . 0.9 OUTLIER -86.59 150.04 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.062 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.044 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.613 ' HA ' ' O ' ' B' ' 100' ' ' HIS . 35.2 mt-10 -116.58 94.77 4.75 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.862 168.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.441 ' O ' ' HA ' ' B' ' 101' ' ' ILE . 16.6 m -114.86 -171.3 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.508 -177.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -103.4 -23.15 13.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.797 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.425 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.6 pt-20 -170.27 161.68 8.33 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.204 176.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.6 150.03 69.18 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.504 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -72.96 174.17 12.39 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.805 2.337 . . . . 0.0 112.142 176.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -59.66 146.09 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.983 0.421 . . . . 0.0 110.503 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.6 -16.36 54.92 Favored Glycine 0 N--CA 1.446 -0.699 0 N-CA-C 111.211 -0.755 . . . . 0.0 111.211 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.33 153.41 18.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.935 0.398 . . . . 0.0 111.174 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -110.51 100.88 9.62 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.114 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.0 ttt-85 -100.34 144.75 28.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.124 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.251 1.15 0 CA-C-O 118.928 -0.558 . . . . 0.0 110.551 -176.146 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.478 0.61 0 N-CA-C 110.759 -0.516 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 69.8 m-70 70.07 -60.89 0.47 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.379 0.672 . . . . 0.0 111.42 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -99.74 134.24 42.93 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 177.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -87.55 156.93 19.29 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.586 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -127.69 156.65 42.04 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.46 0.648 . . . . 0.0 111.212 -177.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -154.37 -9.91 0.14 Allowed 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.91 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -78.35 -2.81 39.97 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.549 175.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.9 t -55.97 120.11 31.36 Favored Pre-proline 0 N--CA 1.444 -0.741 0 CA-C-N 114.296 -1.32 . . . . 0.0 110.344 177.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -66.18 128.95 20.53 Favored 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.261 1.974 . . . . 0.0 111.738 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.626 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 23.2 tt0 -104.68 101.37 11.01 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 121.533 0.682 . . . . 0.0 109.733 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 94.3 m-85 -85.07 157.05 20.82 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.767 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.45 ' HG2' ' HD2' ' B' ' 37' ' ' LYS . 37.7 tt0 -126.34 112.11 15.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.252 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 59.3 t -93.55 128.61 44.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 O-C-N 123.469 0.481 . . . . 0.0 111.183 -177.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.45 ' HD2' ' HG2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -129.86 119.53 23.47 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.43 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.546 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.0 ttt -104.35 140.56 37.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.431 -175.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.463 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 2.2 tmtp? -149.26 138.08 21.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 110.696 -174.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.479 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 8.6 mpt_? -98.75 135.84 39.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.201 -177.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.463 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 26.6 m-85 -115.14 143.51 45.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.188 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -127.56 101.92 6.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.336 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 98.55 32.04 6.17 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.541 -0.837 . . . . 0.0 112.519 178.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.19 172.1 10.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.473 -0.195 . . . . 0.0 110.473 179.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.84 -27.26 63.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.447 0.641 . . . . 0.0 110.531 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.661 ' HA ' ' O ' ' B' ' 111' ' ' ILE . 1.3 p90 -120.59 143.87 48.41 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.204 -0.907 . . . . 0.0 108.748 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.503 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.7 mppt? -101.82 -22.35 14.38 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.394 0.616 . . . . 0.0 109.418 -176.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.603 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -138.94 132.92 31.12 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.815 -178.423 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -119.75 129.57 54.56 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.603 HD11 HD12 ' B' ' 48' ' ' LEU . 2.3 mp -124.7 127.96 73.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.494 HD11 ' CE2' ' B' ' 108' ' ' TYR . 3.1 mm? -111.04 121.54 45.62 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' B' ' 35' ' ' GLU . 4.5 mp -126.18 102.67 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 177.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.491 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 12.8 pt-20 -112.34 154.34 25.87 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.12 0.486 . . . . 0.0 110.628 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -99.1 111.35 23.76 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.535 -176.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' B' ' 55' ' ' LYS . 0.0 OUTLIER -134.79 92.57 2.91 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.504 0.669 . . . . 0.0 110.742 179.336 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.626 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -131.88 162.62 55.37 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.287 176.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.545 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 11.2 Cg_endo -53.59 -45.28 42.2 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.788 2.326 . . . . 0.0 111.798 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . 0.485 ' ND2' ' HB2' ' B' ' 57' ' ' PRO . 0.6 OUTLIER -146.82 73.63 1.32 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.35 179.556 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.443 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 2.4 m -67.13 128.07 35.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.777 -174.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -132.87 73.62 75.48 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.378 174.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.2 162.69 41.71 Favored 'Trans proline' 0 C--O 1.238 0.488 0 C-N-CA 122.72 2.28 . . . . 0.0 112.842 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -86.27 -76.05 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.243 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -159.87 -175.59 5.21 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.274 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -127.7 114.23 17.05 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.445 178.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -138.8 79.81 26.97 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-O 121.231 0.539 . . . . 0.0 109.745 175.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.463 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 66.8 Cg_endo -77.1 150.81 29.88 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.735 2.29 . . . . 0.0 112.345 -178.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 17.0 m -153.57 143.63 22.12 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.338 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.416 ' HB2' HD23 ' B' ' 75' ' ' LEU . 63.1 t80 -104.54 113.4 26.94 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.296 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.504 HD21 ' HB ' ' B' ' 74' ' ' ILE . 0.8 OUTLIER -95.57 108.26 20.5 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.502 177.128 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -60.03 -28.35 67.68 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.196 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.19 -44.37 64.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.248 179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.512 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.4 mt-10 -114.15 3.38 15.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.996 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 47.8 43.74 17.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.068 0.947 . . . . 0.0 111.453 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.512 HG13 ' O ' ' B' ' 72' ' ' GLU . 70.0 mt -121.93 138.09 53.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.142 -177.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.416 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.5 tm? -100.42 101.68 12.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.463 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.1 OUTLIER -89.19 139.48 30.44 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.511 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 44.8 mm -91.73 -53.23 9.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.499 -178.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 15.4 p30 -162.48 -165.99 1.28 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.866 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -77.63 0.59 69.91 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.686 178.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -92.22 -42.4 9.89 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -178.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.491 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -158.63 153.74 25.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.935 -178.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 31.3 t -133.53 150.2 51.68 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.325 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.4 mm -114.79 105.73 52.88 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.999 0.428 . . . . 0.0 110.95 -174.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -80.29 136.06 11.12 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.422 2.082 . . . . 0.0 112.599 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -99.73 146.67 32.25 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.102 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.51 ' HG2' HD12 ' B' ' 89' ' ' ILE . 23.3 Cg_endo -62.49 141.7 87.59 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.459 2.106 . . . . 0.0 111.654 176.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -73.88 -7.06 50.85 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.55 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . 0.502 ' OD1' ' HB2' ' B' ' 86' ' ' PRO . 4.6 p-10 -89.29 -4.19 58.23 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.876 0.37 . . . . 0.0 110.781 -178.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.51 HD12 ' HG2' ' B' ' 86' ' ' PRO . 59.7 mt -112.29 135.55 51.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.318 179.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 4.2 p -87.21 116.34 29.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.299 0.571 . . . . 0.0 110.19 177.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 54.1 t -121.91 133.56 67.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.293 0.568 . . . . 0.0 111.184 -174.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.474 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.27 159.3 42.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.566 177.915 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.451 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -64.12 -16.67 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.875 -175.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.73 -14.14 49.21 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.025 178.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.474 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 27.4 t70 -109.31 -22.35 12.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.353 0.597 . . . . 0.0 109.978 -177.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.436 HG22 HG13 ' B' ' 98' ' ' ILE . 85.6 mt -71.4 117.42 14.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.081 -0.963 . . . . 0.0 110.619 176.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.469 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 26.0 mmmt -112.28 104.7 12.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.677 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.545 HG22 HG23 ' A' ' 10' ' ' VAL . 53.5 mt -108.87 117.89 55.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.198 0.523 . . . . 0.0 111.48 -177.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.679 ' HD1' HG21 ' A' ' 11' ' ' VAL . 96.1 m-85 -127.78 121.96 31.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.451 -178.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.613 ' O ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 t-80 -104.93 123.13 47.22 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 110.173 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.741 HG22 ' H ' ' B' ' 104' ' ' GLU . 52.4 mt -99.05 120.65 48.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.154 0.502 . . . . 0.0 109.846 175.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' B' ' 102' ' ' ARG . 3.9 ptt180 -75.77 -35.91 59.97 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.756 -176.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.28 -41.27 66.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.101 0.477 . . . . 0.0 110.53 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.741 ' H ' HG22 ' B' ' 101' ' ' ILE . 9.3 tp10 -81.09 -10.9 59.6 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.397 -178.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 30.5 mmm180 58.57 29.49 18.52 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.11 -178.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.485 HG23 ' HB3' ' B' ' 53' ' ' GLU . 85.4 m -127.08 139.77 52.76 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.59 -168.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.49 120.64 43.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.521 177.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.494 ' CE2' HD11 ' B' ' 51' ' ' LEU . 23.7 m-85 -101.33 125.29 47.95 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.714 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.508 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 43.8 mm -113.64 116.39 52.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.114 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.469 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 80.2 m-85 -117.36 124.55 49.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 175.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.661 ' O ' ' HA ' ' B' ' 46' ' ' TYR . 67.0 mt . . . . . 0 C--O 1.245 0.834 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.592 178.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.636 0 N-CA-C 112.077 -0.409 . . . . 0.0 112.077 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.48 ' O ' ' HA ' ' B' ' 71' ' ' ALA . 57.7 Cg_endo -71.68 105.82 1.85 Allowed 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.52 2.147 . . . . 0.0 112.566 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.6 p-80 -144.27 21.8 1.71 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.171 0.51 . . . . 0.0 110.563 178.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -123.46 162.31 23.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.58 -177.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.7 p -132.77 144.55 50.33 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.6 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.413 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.3 m -130.42 142.15 44.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.345 179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.41 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.5 OUTLIER -86.93 137.72 32.13 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.684 0.278 . . . . 0.0 110.251 -178.306 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.403 HG12 ' HA ' ' B' ' 67' ' ' SER . 4.5 mm -110.32 120.57 43.87 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -76.81 135.35 15.77 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.243 1.962 . . . . 0.0 112.068 177.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.1 t -85.06 132.93 30.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.605 178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.499 HG12 HG13 ' A' ' 13' ' ' VAL . 82.0 t -95.93 112.21 27.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 172.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.523 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 40.7 mt-10 -91.42 110.15 21.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.349 0.595 . . . . 0.0 110.453 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.499 HG13 HG12 ' A' ' 11' ' ' VAL . 2.5 m -130.31 -176.18 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.662 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -84.09 -30.04 26.3 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -172.78 -178.65 1.92 Allowed 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.158 177.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.468 HD23 ' HB2' ' A' ' 22' ' ' ARG . 2.4 mm? -77.46 150.83 80.09 Favored Pre-proline 0 N--CA 1.442 -0.834 0 CA-C-O 120.808 0.337 . . . . 0.0 110.129 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -65.39 172.63 7.48 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.544 2.163 . . . . 0.0 111.535 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.94 139.67 56.43 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.354 -178.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.21 -15.38 50.86 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.781 -0.723 . . . . 0.0 111.94 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -84.64 173.29 10.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.762 0.315 . . . . 0.0 110.459 176.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -126.89 100.07 6.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.989 0.423 . . . . 0.0 110.826 -177.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.468 ' HB2' HD23 ' A' ' 16' ' ' LEU . 56.7 ttp85 -109.9 147.42 33.43 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.286 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 37.7 m . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.007 179.154 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo . . . . . 0 N--CA 1.481 0.788 0 N-CA-C 111.304 -0.306 . . . . 0.0 111.304 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 43.1 t-80 -80.63 113.3 18.73 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' B' ' 27' ' ' GLN . 4.1 tp10 67.83 -154.01 0.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.303 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.499 ' H ' ' HG3' ' B' ' 26' ' ' GLU . 2.2 mp0 -92.35 -174.44 3.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.976 0.417 . . . . 0.0 110.491 -177.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . 0.414 ' HB3' ' H ' ' B' ' 29' ' ' GLU . 23.8 mm-40 -82.52 -168.69 2.11 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.389 0.614 . . . . 0.0 111.605 176.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . 0.414 ' H ' ' HB3' ' B' ' 28' ' ' GLN . 0.3 OUTLIER -104.15 -10.39 17.99 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.239 -0.892 . . . . 0.0 111.384 -175.51 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -84.49 -7.38 59.29 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.596 -178.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 50.8 t -60.5 111.8 4.6 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.142 -172.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.611 ' HA ' ' OG ' ' B' ' 59' ' ' SER . 76.3 Cg_endo -80.47 130.23 7.85 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.739 2.292 . . . . 0.0 111.706 175.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.452 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 35.1 tt0 -92.92 97.08 10.51 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 121.348 0.594 . . . . 0.0 109.527 177.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.475 ' HA ' ' O ' ' B' ' 53' ' ' GLU . 78.0 m-85 -83.35 144.05 29.93 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.13 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -120.54 114.43 21.74 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 60.4 t -96.96 129.43 47.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.47 -174.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.419 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -123.0 136.37 54.83 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 175.744 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.728 ' HG2' HD11 ' B' ' 48' ' ' LEU . 0.7 OUTLIER -117.1 127.34 54.05 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.95 0.405 . . . . 0.0 110.922 -179.274 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.651 ' O ' HD13 ' B' ' 48' ' ' LEU . 7.3 tmtm? -125.42 118.48 25.96 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 -175.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.419 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 6.6 mpt_? -90.09 127.12 36.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.257 0.551 . . . . 0.0 111.52 -172.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.592 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 25.5 m-85 -109.28 167.74 9.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.86 176.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.92 127.17 9.17 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.465 174.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 74.56 33.75 55.35 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.472 -179.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -127.17 172.18 10.77 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.768 -0.254 . . . . 0.0 110.401 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.52 -22.96 65.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.293 0.568 . . . . 0.0 110.5 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.645 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.3 OUTLIER -130.83 142.06 50.37 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.958 178.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.504 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -97.99 -19.21 18.16 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.059 0.457 . . . . 0.0 109.83 -176.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.728 HD11 ' HG2' ' B' ' 38' ' ' MET . 0.0 OUTLIER -143.22 134.74 26.3 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.234 179.105 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.401 ' HB2' ' CE1' ' B' ' 41' ' ' PHE . 34.4 ttp180 -113.73 113.0 24.37 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 171.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.583 HD12 ' N ' ' B' ' 50' ' ' ILE . 2.1 mp -108.34 127.86 64.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.8 mm? -110.12 117.96 35.12 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.282 -177.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.5 mp -123.93 103.71 13.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 16.5 pt-20 -113.23 153.79 27.8 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.968 0.413 . . . . 0.0 110.543 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.438 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -96.85 112.67 24.32 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.899 -177.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.2 ptmt -138.43 91.32 2.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.027 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.706 ' HB3' ' OG ' ' B' ' 59' ' ' SER . . . -137.68 162.59 53.77 Favored Pre-proline 0 C--N 1.321 -0.659 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.947 172.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.415 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 25.9 Cg_endo -59.57 -40.62 64.16 Favored 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.661 2.241 . . . . 0.0 111.079 172.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -136.67 93.99 2.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.403 -177.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.706 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 58.8 m -119.45 132.54 55.82 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.094 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -132.88 72.97 76.44 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.881 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.0 147.27 23.78 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.693 2.262 . . . . 0.0 112.431 177.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . 0.568 ' HB3' ' HE ' ' B' ' 63' ' ' ARG . 9.5 m-20 -103.37 -68.31 0.84 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.452 179.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.568 ' HE ' ' HB3' ' B' ' 62' ' ' ASP . 0.4 OUTLIER -160.11 170.05 22.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.905 -0.588 . . . . 0.0 109.904 -179.217 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -116.11 147.21 41.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.665 0.745 . . . . 0.0 110.794 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 19.4 t -142.23 78.96 16.36 Favored Pre-proline 0 C--N 1.305 -1.337 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.803 172.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.415 ' HB3' ' HA ' ' B' ' 77' ' ' ILE . 71.9 Cg_endo -78.65 156.64 28.05 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.937 2.425 . . . . 0.0 112.402 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . 0.473 ' HB2' ' CE2' ' B' ' 76' ' ' TYR . 20.3 m -158.51 144.88 17.18 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.229 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.451 ' HB2' HD23 ' B' ' 75' ' ' LEU . 55.7 t80 -106.39 119.04 38.23 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.583 -177.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.404 HD21 ' HB ' ' B' ' 74' ' ' ILE . 1.0 OUTLIER -100.02 113.47 26.08 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.37 175.759 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -62.71 -32.09 73.13 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.631 -177.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 2' ' ' PRO . . . -52.62 -50.12 63.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.666 -178.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.528 ' O ' HG13 ' B' ' 74' ' ' ILE . 3.0 mm-40 -103.6 1.6 32.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.391 -178.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 46.97 46.07 15.67 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 124.375 1.047 . . . . 0.0 111.537 -175.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 72' ' ' GLU . 63.7 mt -124.0 138.41 53.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.191 -178.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.451 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.0 tm? -104.82 102.26 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.473 ' CE2' ' HB2' ' B' ' 67' ' ' SER . 2.2 p90 -88.75 138.6 31.27 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.224 -0.59 . . . . 0.0 109.59 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . 0.415 ' HA ' ' HB3' ' B' ' 66' ' ' PRO . 34.9 mm -92.3 -46.53 14.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.084 -175.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -150.26 -179.94 7.61 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.65 1.94 60.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.585 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 57.6 mttt -101.35 -33.97 9.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.626 -0.287 . . . . 0.0 111.146 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -154.4 153.32 31.39 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 121.309 0.576 . . . . 0.0 112.226 178.543 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 33.1 p -129.73 151.78 49.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.178 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 50.9 mm -111.9 105.01 56.51 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 120.849 0.357 . . . . 0.0 110.514 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -80.34 135.78 10.91 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.632 2.221 . . . . 0.0 112.713 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -103.14 148.26 35.37 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.17 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.431 ' HG2' HD12 ' B' ' 89' ' ' ILE . 32.6 Cg_endo -66.63 137.73 47.07 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.18 1.92 . . . . 0.0 111.389 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.465 ' HA ' ' HD3' ' B' ' 87' ' ' ARG . 0.0 OUTLIER -70.5 -3.99 20.62 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.739 -175.832 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -82.62 -11.58 58.29 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.465 0.65 . . . . 0.0 109.972 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.431 HD12 ' HG2' ' B' ' 86' ' ' PRO . 54.6 mt -107.59 132.04 56.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.534 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 57.8 t -82.91 110.59 18.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 175.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 49.1 t -115.34 132.77 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.67 -174.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.608 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.27 162.2 36.04 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.617 177.481 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.413 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.63 -17.82 63.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.89 -175.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.26 -16.41 40.25 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.794 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.608 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 21.0 t0 -104.57 -23.07 13.16 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.547 0.689 . . . . 0.0 109.672 -176.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 81.7 mt -73.44 114.6 13.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.969 177.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.426 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 24.1 mmmt -108.56 105.96 15.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.808 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 48.9 mt -109.38 116.18 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.884 0.373 . . . . 0.0 110.856 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.427 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.7 m-85 -129.39 119.83 24.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.073 0.463 . . . . 0.0 110.72 -177.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.523 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 14.8 t-80 -102.62 114.2 28.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.552 HG22 ' H ' ' B' ' 104' ' ' GLU . 4.2 mp -95.87 101.14 12.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 171.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -78.5 -15.8 58.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.471 -174.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.44 -41.64 80.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.877 0.37 . . . . 0.0 110.152 175.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.552 ' H ' HG22 ' B' ' 101' ' ' ILE . 13.6 mm-40 -94.32 -3.67 50.05 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.493 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 59.15 35.78 23.79 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.404 -177.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.424 HG23 ' HB3' ' B' ' 53' ' ' GLU . 27.6 m -125.63 134.75 51.78 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.982 0.42 . . . . 0.0 110.866 -173.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 49.3 tp -108.63 117.49 34.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.232 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.553 ' CE2' HD11 ' B' ' 51' ' ' LEU . 35.7 m-85 -97.78 129.1 44.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.081 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.58 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 42.2 mm -116.06 123.1 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.961 176.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.426 ' HB2' ' HB2' ' B' ' 97' ' ' LYS . 83.7 m-85 -121.34 127.54 51.38 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.645 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 65.3 mt . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.594 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.744 0 N-CA-C 111.761 -0.536 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.57 -25.12 77.79 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 123.031 2.487 . . . . 0.0 113.208 -179.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -147.14 -72.28 0.22 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.67 0.271 . . . . 0.0 110.73 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 56.6 ttm -172.68 150.39 2.17 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -176.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.3 p -152.43 132.54 13.49 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.61 0.243 . . . . 0.0 110.423 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.529 HG21 ' HB2' ' B' ' 93' ' ' ALA . 15.2 m -127.45 144.37 37.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.676 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -84.98 138.68 32.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.428 ' HB ' HD12 ' B' ' 98' ' ' ILE . 7.7 mm -107.56 119.85 49.26 Favored Pre-proline 0 C--N 1.321 -0.656 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.119 178.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.38 135.62 24.86 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.557 2.171 . . . . 0.0 112.575 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 45.0 t -93.54 124.23 45.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.566 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.454 HG12 HG13 ' A' ' 13' ' ' VAL . 58.7 t -92.55 118.47 38.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.439 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 36.8 mt-10 -94.0 111.02 22.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.379 0.609 . . . . 0.0 110.269 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.454 HG13 HG12 ' A' ' 11' ' ' VAL . 2.7 m -127.74 -175.81 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.107 -177.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -85.97 -29.75 23.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 178.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.519 ' HA ' HG12 ' B' ' 101' ' ' ILE . 13.0 pt-20 -178.28 175.26 1.21 Allowed 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.496 -1.229 . . . . 0.0 110.077 173.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.463 ' H ' HD22 ' A' ' 16' ' ' LEU . 1.8 mm? -71.88 153.62 92.96 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.788 0.327 . . . . 0.0 111.119 -174.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.81 173.04 15.1 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.193 1.929 . . . . 0.0 111.446 174.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.25 138.76 57.87 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.619 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.61 -10.46 41.89 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.831 -175.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.4 ' HA ' ' OH ' ' B' ' 46' ' ' TYR . 60.6 m-85 -103.92 152.65 21.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.992 0.425 . . . . 0.0 111.598 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -112.91 104.0 11.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.327 -176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.626 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 63.7 ttp85 -105.52 149.21 26.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.159 -176.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.611 -0.709 . . . . 0.0 109.941 175.559 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo . . . . . 0 N--CA 1.48 0.733 0 N-CA-C 111.251 -0.327 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -139.69 45.44 1.92 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.441 0.638 . . . . 0.0 110.688 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -86.87 -163.55 0.93 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.035 177.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -87.81 142.68 27.62 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . 0.546 ' HG3' HG21 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -107.71 163.34 13.18 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.447 -177.774 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -148.64 -19.94 0.32 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.143 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -82.11 -7.52 59.62 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.888 0.375 . . . . 0.0 110.892 -176.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.546 HG21 ' HG3' ' B' ' 28' ' ' GLN . 58.6 t -56.25 120.34 34.32 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.467 -177.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.511 ' HA ' ' HB3' ' B' ' 59' ' ' SER . 43.2 Cg_endo -71.68 129.51 15.7 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.419 2.079 . . . . 0.0 112.452 177.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.496 ' HB3' ' HB2' ' B' ' 56' ' ' ALA . 41.9 tt0 -102.09 100.6 10.86 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.494 ' HB2' HD21 ' B' ' 81' ' ' LEU . 81.4 m-85 -87.35 155.98 19.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.927 -178.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -130.21 118.06 20.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.961 175.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 58.7 t -95.96 138.89 20.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.822 -174.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.482 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 0.0 OUTLIER -132.52 151.75 51.81 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 175.312 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.535 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -132.77 141.7 48.64 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' B' ' 40' ' ' ARG . 8.7 tmtm? -144.88 135.76 24.74 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.636 -176.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.488 ' HD2' ' N ' ' B' ' 40' ' ' ARG . 7.6 mpt_? -98.61 129.48 45.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.995 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.474 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 31.3 m-85 -107.91 146.9 31.73 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.5 177.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -129.37 100.11 5.45 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.903 179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 93.39 45.19 3.55 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.203 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -133.45 170.74 15.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.78 -17.04 63.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.281 0.562 . . . . 0.0 110.776 177.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.536 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.9 OUTLIER -130.34 140.16 50.64 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.538 ' HD3' ' N ' ' B' ' 47' ' ' LYS . 2.8 mppt? -95.28 -24.37 16.8 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.226 0.536 . . . . 0.0 109.668 -174.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.588 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -137.59 136.76 37.85 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.249 -177.3 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -120.72 129.58 53.7 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.588 HD11 HD12 ' B' ' 48' ' ' LEU . 2.6 mp -123.03 129.85 74.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.0 mm? -114.26 118.89 35.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.51 -175.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.6 mp -124.36 103.53 12.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 177.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.53 ' HB3' HG23 ' B' ' 106' ' ' THR . 13.1 pt-20 -107.22 153.65 22.38 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.579 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -99.23 112.46 24.61 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.646 -178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -136.88 92.82 2.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.37 0.605 . . . . 0.0 110.682 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.661 ' HB3' ' HB3' ' B' ' 59' ' ' SER . . . -137.89 162.29 55.12 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.178 176.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.501 ' HD2' ' HB1' ' B' ' 56' ' ' ALA . 25.7 Cg_endo -64.2 -40.36 26.4 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 121.949 1.766 . . . . 0.0 112.591 179.109 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -136.92 36.95 2.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.644 -173.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.661 ' HB3' ' HB3' ' B' ' 56' ' ' ALA . 4.6 p -76.01 132.36 40.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.876 0.37 . . . . 0.0 111.937 -177.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -135.64 76.96 53.28 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.707 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.8 139.63 44.21 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.382 2.055 . . . . 0.0 111.803 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -91.18 -44.12 9.44 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.761 -177.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -162.68 174.87 11.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.978 -174.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -125.89 133.16 52.0 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.965 175.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 28.7 p -136.38 79.46 42.25 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.169 176.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.404 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 91.4 Cg_endo -87.8 153.86 7.37 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 122.828 2.352 . . . . 0.0 112.391 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . 0.418 ' HA ' HG12 ' A' ' 8' ' ' ILE . 24.7 m -157.18 150.29 23.74 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.501 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.421 ' HB2' HD23 ' B' ' 75' ' ' LEU . 48.8 t80 -109.05 125.45 52.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.507 -178.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -106.54 117.93 35.33 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.901 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -70.17 -14.92 62.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.828 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.13 -50.94 71.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.101 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.434 ' O ' HD13 ' B' ' 74' ' ' ILE . 6.3 mm-40 -113.36 0.1 14.68 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.307 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' B' ' 85' ' ' LEU . 1.8 p-10 51.35 48.28 23.27 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 124.712 1.257 . . . . 0.0 111.014 -171.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' B' ' 84' ' ' PRO . 0.3 OUTLIER -107.27 146.97 12.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.736 177.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.427 ' HB2' HD11 ' B' ' 85' ' ' LEU . 3.2 tm? -115.72 102.38 9.68 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 176.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 82' ' ' SER . 0.1 OUTLIER -91.07 139.93 30.3 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -178.565 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 39.0 mm -93.25 -46.42 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.618 -174.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.429 ' C ' ' H ' ' B' ' 80' ' ' LYS . 6.2 t-20 -161.93 178.59 8.75 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -175.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.17 32.83 1.31 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.195 178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' B' ' 78' ' ' ASN . 28.2 mmmt -125.07 -44.66 1.9 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -179.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.494 HD21 ' HB2' ' B' ' 34' ' ' TYR . 1.0 OUTLIER -152.25 153.65 34.18 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.784 -177.978 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 13.3 p -126.52 145.82 50.36 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.055 178.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 46.6 mm -107.83 111.07 62.55 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.603 -178.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.602 ' HA ' HD12 ' B' ' 74' ' ' ILE . 59.8 Cg_endo -75.69 132.8 14.88 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 121.992 1.795 . . . . 0.0 111.899 178.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' B' ' 73' ' ' ASN . 78.7 mt -102.6 148.26 35.25 Favored Pre-proline 0 C--N 1.323 -0.561 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.773 -176.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.93 142.93 43.89 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.739 2.293 . . . . 0.0 112.327 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.431 ' N ' ' HD2' ' B' ' 87' ' ' ARG . 9.1 mpt_? -79.07 -6.48 56.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.931 -177.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -79.52 -18.83 51.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.639 0.733 . . . . 0.0 109.714 179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 55.8 mt -107.56 131.5 57.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.773 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.2 115.83 27.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . 0.411 HG13 ' CZ ' ' B' ' 68' ' ' TYR . 2.2 p -126.24 134.85 65.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.324 0.583 . . . . 0.0 111.222 -173.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . 0.45 ' ND2' ' HB2' ' B' ' 95' ' ' ASP . 0.0 OUTLIER -141.79 164.91 28.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.855 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.529 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -63.77 -16.85 62.23 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.867 -175.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.48 -12.41 43.08 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.177 0.513 . . . . 0.0 110.905 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . 0.45 ' HB2' ' ND2' ' B' ' 92' ' ' ASN . 25.5 t0 -109.24 -26.87 9.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.951 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.406 HG22 HG13 ' B' ' 98' ' ' ILE . 82.5 mt -69.79 114.98 7.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.04 177.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.414 ' HB2' ' HB2' ' B' ' 110' ' ' TYR . 27.1 mmmt -108.45 103.42 12.56 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.401 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.428 HD12 ' HB ' ' A' ' 8' ' ' ILE . 40.4 mt -107.14 121.51 60.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.796 179.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.436 ' CD2' ' HB ' ' A' ' 11' ' ' VAL . 76.3 m-85 -134.56 121.2 20.61 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.275 -178.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.439 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 17.5 t-80 -96.34 110.75 23.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.463 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.811 HG22 ' H ' ' B' ' 104' ' ' GLU . 3.2 mp -91.87 107.55 18.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 173.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -73.85 -23.19 59.58 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.971 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -60.64 -47.59 85.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.164 0.507 . . . . 0.0 110.643 177.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.811 ' H ' HG22 ' B' ' 101' ' ' ILE . 15.6 mm-40 -92.61 -3.42 55.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.641 -179.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 57.99 34.39 24.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.128 -176.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.53 HG23 ' HB3' ' B' ' 53' ' ' GLU . 41.2 m -129.16 141.6 51.12 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.201 -170.213 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 53.8 tp -107.12 120.31 41.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.007 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.706 ' CD1' HD13 ' B' ' 101' ' ' ILE . 21.2 m-85 -102.6 130.61 49.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.014 -178.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.571 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 36.5 mm -115.49 120.23 64.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.9 177.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.441 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 79.7 m-85 -121.01 126.66 50.49 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.536 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 66.3 mt . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.646 -0.692 . . . . 0.0 109.82 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.845 0 N-CA-C 112.096 -0.401 . . . . 0.0 112.096 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -78.83 29.58 0.47 Allowed 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.083 2.522 . . . . 0.0 113.774 -177.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -177.45 -70.86 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.866 0.365 . . . . 0.0 110.097 176.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.4 tpt -159.55 133.35 7.33 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 -178.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' B' ' 69' ' ' ASN . 2.0 m -149.43 145.16 26.79 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.515 HG21 ' HB2' ' B' ' 93' ' ' ALA . 24.4 m -135.33 152.87 32.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.705 0.288 . . . . 0.0 110.647 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.495 ' H ' ' NE2' ' A' ' 7' ' ' GLN . 0.4 OUTLIER -96.76 138.38 34.41 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.753 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.405 ' HB ' HD12 ' B' ' 98' ' ' ILE . 4.6 mm -111.86 121.26 40.15 Favored Pre-proline 0 C--N 1.323 -0.565 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.311 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.64 130.34 18.09 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.085 1.857 . . . . 0.0 112.05 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.468 HG23 HG22 ' B' ' 98' ' ' ILE . 2.1 p -100.77 127.1 54.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.188 0.518 . . . . 0.0 110.667 179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.565 HG12 HG13 ' A' ' 13' ' ' VAL . 83.0 t -95.5 123.07 47.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.128 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' B' ' 100' ' ' HIS . 32.2 mt-10 -92.19 109.69 21.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.479 0.657 . . . . 0.0 110.514 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.565 HG13 HG12 ' A' ' 11' ' ' VAL . 3.5 m -126.22 -176.12 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.423 -176.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -91.27 -25.64 19.38 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.436 ' HA ' ' CD1' ' B' ' 101' ' ' ILE . 12.5 pt-20 -171.51 170.54 5.75 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.75 176.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.478 ' H ' HD22 ' A' ' 16' ' ' LEU . 2.1 mm? -74.1 151.63 88.26 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.521 -178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -59.41 171.54 2.44 Favored 'Trans proline' 0 C--O 1.24 0.622 0 C-N-CA 122.374 2.049 . . . . 0.0 111.81 172.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.74 130.67 42.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.044 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 110.86 -6.33 29.32 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.375 -177.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 -89.76 164.45 14.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.923 0.392 . . . . 0.0 111.363 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -115.83 97.36 6.07 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.363 -177.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.498 ' HG3' ' CE2' ' B' ' 108' ' ' TYR . 35.1 ttp85 -101.76 145.69 28.79 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.424 -175.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 C--O 1.251 1.184 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.386 178.984 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.478 0.564 0 N-CA-C 110.858 -0.478 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -96.86 -29.46 13.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.413 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 50.9 mm-40 -88.1 -163.75 1.0 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.875 -176.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -63.19 142.38 58.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.376 0.608 . . . . 0.0 111.109 -177.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . 0.407 ' HB3' ' OD1' ' B' ' 30' ' ' ASP . 28.3 mt-30 -72.63 153.76 41.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.0 -178.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -82.56 -16.16 49.58 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.627 -175.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.423 ' HB2' ' HD3' ' B' ' 60' ' ' LYS . 5.5 p-10 -87.26 2.05 51.32 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.892 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 66.0 t -74.04 115.71 45.24 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.621 176.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -62.86 138.96 71.67 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.72 2.28 . . . . 0.0 112.843 -176.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.653 ' H ' ' HB2' ' B' ' 56' ' ' ALA . 23.8 tt0 -93.8 100.99 13.08 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.529 ' HB2' HD21 ' B' ' 81' ' ' LEU . 77.4 m-85 -88.09 142.71 27.56 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.297 176.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -122.58 112.03 17.5 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.43 -178.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' B' ' 51' ' ' LEU . 56.9 t -96.93 136.67 26.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.027 -171.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' B' ' 37' ' ' LYS . 9.0 mptt -132.52 132.62 42.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 174.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' MET . . . . . 0.565 ' HG2' HD11 ' B' ' 48' ' ' LEU . 2.1 ttt -113.57 138.82 49.61 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.473 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.542 ' HD2' ' CE1' ' B' ' 41' ' ' PHE . 9.8 tmtm? -143.49 136.63 27.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.948 0.404 . . . . 0.0 110.706 -176.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -100.95 135.94 41.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.825 -177.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.542 ' CE1' ' HD2' ' B' ' 39' ' ' LYS . 35.6 m-85 -111.83 155.73 23.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.987 0.422 . . . . 0.0 110.709 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -127.21 119.25 25.97 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.968 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . 63.41 46.98 91.4 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.415 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -126.57 171.04 11.44 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.58 -2.74 18.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.96 0.409 . . . . 0.0 111.101 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' TYR . . . . . 0.535 ' HA ' ' OXT' ' B' ' 111' ' ' ILE . 0.2 OUTLIER -150.06 128.15 11.95 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -84.49 -28.54 26.69 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.216 -173.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.638 HD12 HD11 ' B' ' 50' ' ' ILE . 0.2 OUTLIER -133.59 135.78 44.49 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.65 -178.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -121.39 125.28 46.57 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.527 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.638 HD11 HD12 ' B' ' 48' ' ' LEU . 1.8 mp -122.26 129.47 75.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.646 HD11 ' CE2' ' B' ' 108' ' ' TYR . 2.5 mm? -111.99 114.88 28.03 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.633 -178.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.18 104.53 14.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.459 ' O ' ' HA ' ' B' ' 34' ' ' TYR . 14.9 pt-20 -108.41 153.08 23.8 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.339 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' ASN . . . . . 0.436 ' C ' HD22 ' B' ' 54' ' ' ASN . 0.2 OUTLIER -97.3 110.33 22.9 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.528 -179.343 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -137.32 91.59 2.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.086 0.47 . . . . 0.0 110.815 178.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' ALA . . . . . 0.653 ' HB2' ' H ' ' B' ' 33' ' ' GLU . . . -138.42 156.19 73.53 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.534 176.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.18 -38.56 85.46 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.479 2.119 . . . . 0.0 111.495 176.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -132.68 73.33 1.52 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.345 -177.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' SER . . . . . 0.566 ' OG ' ' HB3' ' B' ' 56' ' ' ALA . 19.8 m -88.15 122.14 31.37 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.335 -178.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.423 ' HD3' ' HB2' ' B' ' 30' ' ' ASP . 27.6 mtpp -130.34 73.86 80.87 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.848 175.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.93 137.89 17.99 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 122.419 2.079 . . . . 0.0 111.726 174.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -92.67 -62.64 1.35 Allowed 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.669 -177.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -159.24 172.17 18.52 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.956 -178.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -124.94 129.65 50.78 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.591 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 10.9 m -135.33 78.97 50.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . 0.472 ' HA ' ' O ' ' B' ' 76' ' ' TYR . 60.3 Cg_endo -77.19 149.18 27.95 Favored 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.312 2.008 . . . . 0.0 112.088 -179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.7 m -154.28 141.89 19.86 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.239 -179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.456 ' HB2' HD23 ' B' ' 75' ' ' LEU . 43.1 t80 -105.74 113.06 26.39 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.311 -178.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' SER . 1.2 p-10 -95.63 106.1 18.16 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 176.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -56.42 -34.07 66.42 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.335 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -50.72 -45.21 58.4 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.859 -176.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . 0.523 ' O ' HG13 ' B' ' 74' ' ' ILE . 7.0 mt-10 -112.31 5.31 18.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.096 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . 0.452 HD21 ' NE ' ' B' ' 87' ' ' ARG . 2.6 p-10 48.86 42.31 19.99 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.755 1.284 . . . . 0.0 111.6 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.523 HG13 ' O ' ' B' ' 72' ' ' GLU . 65.7 mt -118.75 135.77 58.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.168 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.456 HD23 ' HB2' ' B' ' 68' ' ' TYR . 3.1 tm? -103.67 102.99 12.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 178.301 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.472 ' O ' ' HA ' ' B' ' 66' ' ' PRO . 0.2 OUTLIER -89.75 141.47 28.59 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 -178.737 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' ILE . . . . . . . . . . . . . 43.2 mm -97.97 -45.75 12.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.863 -176.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.406 ' OD1' ' HG2' ' B' ' 80' ' ' LYS . 3.3 t-20 -156.53 176.48 12.65 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.013 -172.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.14 2.4 44.02 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.238 -0.745 . . . . 0.0 111.238 173.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . 0.406 ' HG2' ' OD1' ' B' ' 78' ' ' ASN . 44.1 mmtm -89.22 -43.94 10.63 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.529 HD21 ' HB2' ' B' ' 34' ' ' TYR . 0.7 OUTLIER -157.0 153.46 28.03 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.495 0.664 . . . . 0.0 112.495 -176.258 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' B' ' 76' ' ' TYR . 15.8 p -124.28 146.91 48.48 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.812 176.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.6 mm -108.18 102.35 45.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 120.888 0.375 . . . . 0.0 110.774 -177.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.46 ' HA ' HG12 ' B' ' 74' ' ' ILE . 60.5 Cg_endo -75.81 126.09 9.22 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.213 1.942 . . . . 0.0 112.127 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 83.5 mt -92.63 154.92 42.38 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.465 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' PRO . . . . . 0.436 ' HG2' HD12 ' B' ' 89' ' ' ILE . 39.3 Cg_endo -68.53 138.49 42.15 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 111.877 176.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' ARG . . . . . 0.452 ' NE ' HD21 ' B' ' 73' ' ' ASN . 9.1 mpt_? -80.69 -0.2 37.25 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -87.68 -10.35 51.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.386 0.612 . . . . 0.0 110.362 179.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' ILE . . . . . 0.516 ' CD1' HD23 ' B' ' 48' ' ' LEU . 57.4 mt -112.47 137.77 44.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.196 -175.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 64.6 t -83.19 111.73 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.917 177.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' VAL . . . . . . . . . . . . . 92.7 t -118.69 131.32 71.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.597 0.713 . . . . 0.0 111.652 -174.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.35 159.89 41.34 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.228 176.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.515 ' HB2' HG21 ' A' ' 6' ' ' VAL . . . -64.64 -14.79 59.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.12 0.486 . . . . 0.0 111.55 -177.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.12 -26.19 52.95 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.077 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.38 -26.27 14.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.991 0.424 . . . . 0.0 110.582 -178.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 89.6 mt -69.0 113.4 4.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.764 -176.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -110.41 108.15 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.875 178.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' ILE . . . . . 0.468 HG22 HG23 ' A' ' 10' ' ' VAL . 50.7 mt -111.92 116.39 52.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.85 0.357 . . . . 0.0 110.861 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.409 ' CD1' ' HB ' ' A' ' 11' ' ' VAL . 95.3 m-85 -128.62 119.09 24.07 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.471 179.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' HIS . . . . . 0.475 ' HB3' ' HG2' ' A' ' 12' ' ' GLU . 13.1 t-80 -98.07 110.21 22.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.575 -179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' ILE . . . . . 0.636 HG22 ' H ' ' B' ' 104' ' ' GLU . 61.1 mt -91.28 104.57 15.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.649 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.462 ' HG2' ' CE1' ' B' ' 100' ' ' HIS . 20.7 mtm180 -76.12 -28.24 57.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.895 -177.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -59.9 -42.16 93.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.798 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.636 ' H ' HG22 ' B' ' 101' ' ' ILE . 8.0 tp10 -99.05 -0.93 40.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.174 -177.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 58.61 30.24 19.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.788 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' THR . . . . . 0.4 HG23 ' HB3' ' B' ' 53' ' ' GLU . 28.0 m -127.99 139.22 52.69 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.016 0.436 . . . . 0.0 111.155 -172.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' LEU . . . . . . . . . . . . . 51.8 tp -109.05 120.23 41.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.296 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' TYR . . . . . 0.646 ' CE2' HD11 ' B' ' 51' ' ' LEU . 31.5 m-85 -102.08 127.0 49.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' B' ' 50' ' ' ILE . 32.6 mm -113.87 121.31 65.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.798 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' TYR . . . . . 0.489 ' CE1' ' HB3' ' B' ' 108' ' ' TYR . 84.0 m-85 -122.32 126.5 48.22 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.535 ' OXT' ' HA ' ' B' ' 46' ' ' TYR . 55.4 mt . . . . . 0 C--O 1.245 0.865 0 CA-C-O 118.782 -0.627 . . . . 0.0 110.309 -177.381 . . . . . . . . 1 1 . 1 stop_ save_