data_2asq_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 2asq _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm . . . . . 0 N--CA 1.456 -0.149 0 N-CA-C 110.205 -0.294 . . . . 2.2400000000000002 110.205 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.0 ttpm? -113.72 120.22 40.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.29 0.567 . . . . 3.7000000000000002 111.538 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.5 mt -104.18 150.24 24.55 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.139 -0.689 . . . . 1.77 109.139 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -103.93 121.39 43.03 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.92 -0.312 . . . . 3.1299999999999999 110.878 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.6 t -93.08 121.39 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.904 -0.589 . . . . 1.76 109.988 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.4 mm -103.37 120.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.907 0.384 . . . . 2.6000000000000001 111.017 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.58 167.87 24.83 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.653 -0.703 . . . . 2.6400000000000001 111.583 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -77.01 -17.71 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.116 0.484 . . . . 3.73 110.639 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -85.88 20.96 2.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.465 . . . . 3.2400000000000002 110.364 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 58.96 64.3 1.44 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.596 -0.729 . . . . 3.29 110.91 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -135.76 144.58 45.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.491 -0.777 . . . . 2.5 110.462 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -126.04 94.3 4.06 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.443 -0.577 . . . . 3.0099999999999998 109.443 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.8 mm -90.5 145.4 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.056 -0.52 . . . . 2.3199999999999998 110.9 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.506 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 32.6 m170 -89.02 132.98 34.5 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.888 -0.782 . . . . 2.3999999999999999 108.888 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -123.16 110.52 15.37 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.817 0.341 . . . . 1.9399999999999999 110.884 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.403 ' HB2' HG21 ' B' ' 4' ' ' VAL . 24.3 ttmt -81.48 110.65 17.08 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.949 -0.569 . . . . 3.0099999999999998 110.712 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.7 m -114.13 154.69 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.088 0.47 . . . . 2.0800000000000001 110.465 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HG2' HG22 ' A' ' 41' ' ' THR . 52.6 tttt -106.67 127.27 53.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.378 -0.374 . . . . 3.6299999999999999 110.143 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.621 ' O ' ' HB ' ' A' ' 41' ' ' THR . 63.1 tpp -74.3 85.88 1.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 3.4100000000000001 110.565 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.621 ' HB ' ' O ' ' A' ' 40' ' ' MET . 7.4 t 154.31 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.274 1.03 . . . . 2.5099999999999998 109.055 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.6 m -84.33 134.89 34.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.867 -0.606 . . . . 2.0 110.573 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.15 132.95 54.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.929 -0.578 . . . . 2.96 110.104 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.93 -18.45 60.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 2.3799999999999999 110.833 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 34.0 tptt -53.9 -47.41 71.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.265 0.555 . . . . 2.7599999999999998 109.764 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.9 -43.35 83.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.257 -0.883 . . . . 2.54 111.063 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -44.76 96.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.836 0.351 . . . . 2.9900000000000002 111.077 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -61.25 -52.82 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.041 -0.527 . . . . 2.3900000000000001 112.354 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.7 pt-20 -63.32 -44.12 95.86 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.422 0.527 . . . . 1.8799999999999999 112.422 -178.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.435 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 3.9 m -65.55 -33.44 75.93 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.275 -0.17 . . . . 1.72 111.347 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -69.31 -37.28 77.7 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.574 -0.45 . . . . 1.8899999999999999 110.012 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 66.7 m -60.95 -39.7 90.48 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.256 -0.646 . . . . 1.99 109.256 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.435 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 85.1 mt-30 -63.79 -39.65 94.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.283 -0.872 . . . . 2.1699999999999999 110.156 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -64.84 -33.62 76.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.055 0.455 . . . . 2.4900000000000002 109.788 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -70.87 -35.59 72.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.862 -0.608 . . . . 2.4100000000000001 110.03 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.65 20.63 8.81 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.01 -0.614 . . . . 2.7400000000000002 112.088 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.7 m -132.62 155.83 80.78 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.438 -0.208 . . . . 2.9399999999999999 110.438 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.51 164.03 36.75 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.239 1.959 . . . . 3.0899999999999999 111.217 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 12.3 ttt -71.27 163.04 28.42 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 121.172 -0.211 . . . . 2.5899999999999999 110.564 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 59' ' ' MET . 16.2 m120 75.7 -0.85 3.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.301 0.64 . . . . 3.7599999999999998 111.843 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.6 p -85.26 -29.96 24.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.19 0.519 . . . . 3.0800000000000001 109.809 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.6 mt -119.59 146.13 45.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.472 -0.786 . . . . 2.77 110.594 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -110.8 134.04 52.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.982 -0.554 . . . . 3.5800000000000001 110.023 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -96.44 120.53 36.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 2.3999999999999999 109.315 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.5 mt -108.19 130.57 55.13 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.284 0.564 . . . . 3.6400000000000001 111.572 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -127.46 108.2 10.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.076 -0.965 . . . . 2.9700000000000002 108.409 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.94 17.46 10.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 3.6400000000000001 111.013 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.77 -26.65 20.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.085 -0.579 . . . . 3.7999999999999998 112.285 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -87.03 145.9 26.31 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.87 -0.419 . . . . 5.0899999999999999 109.87 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -81.42 133.71 35.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.219 0.533 . . . . 3.71 110.383 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.0 mm -74.2 113.89 13.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.818 -0.628 . . . . 2.5499999999999998 110.318 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.414 ' HB1' ' CD2' ' A' ' 75' ' ' HIS . . . -72.38 155.72 39.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.809 -0.632 . . . . 3.3799999999999999 110.497 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -65.23 -34.73 79.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.364 0.602 . . . . 2.5899999999999999 110.434 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -86.99 34.24 0.67 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.523 -0.762 . . . . 3.4500000000000002 111.977 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.414 ' CD2' ' HB1' ' A' ' 72' ' ' ALA . 17.2 m170 -114.91 159.34 20.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.11 0.481 . . . . 3.6200000000000001 111.086 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 3.0 p -133.83 157.69 77.21 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.657 -0.702 . . . . 2.9900000000000002 109.761 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -64.28 -14.29 43.04 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.412 2.075 . . . . 2.21 112.762 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -68.37 -36.35 79.06 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.217 -0.447 . . . . 3.3500000000000001 110.673 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.07 177.65 5.91 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.422 -0.584 . . . . 3.1800000000000002 109.422 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.6 mt 73.62 -47.29 0.65 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 123.652 0.595 . . . . 3.2999999999999998 110.825 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.71 47.06 0.75 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.091 -0.576 . . . . 2.8799999999999999 111.858 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.6 mtt -77.85 132.98 38.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.945 0.402 . . . . 2.7000000000000002 110.62 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 32.3 mt-10 -126.2 177.04 6.64 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.121 -0.491 . . . . 3.4399999999999999 110.788 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.407 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.7 tp10 -71.87 143.13 49.51 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.088 -0.708 . . . . 2.3399999999999999 109.088 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 66.64 28.42 9.19 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.504 0.503 . . . . 2.6299999999999999 110.577 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.2 t0 -74.59 168.92 18.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.032 -0.531 . . . . 2.2799999999999998 110.403 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.5 t -120.19 124.62 73.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.754 0.311 . . . . 2.6699999999999999 111.245 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -125.31 133.05 70.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.572 -0.529 . . . . 2.0800000000000001 109.572 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.11 150.57 23.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.914 0.388 . . . . 2.8999999999999999 111.217 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -133.96 128.12 52.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.002 -0.545 . . . . 2.3599999999999999 110.521 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -132.96 162.25 32.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.262 -0.426 . . . . 3.0 110.09 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -89.97 134.88 33.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.021 0.439 . . . . 3.8100000000000001 110.981 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -72.39 150.26 43.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 3.6099999999999999 109.624 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -63.14 -35.97 82.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.388 -0.369 . . . . 5.0499999999999998 111.509 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 p -68.13 -31.63 71.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.859 0.361 . . . . 4.6799999999999997 111.212 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.57 -10.05 68.92 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.017 -0.611 . . . . 3.7999999999999998 111.941 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.707 -1.052 . . . . 3.6800000000000002 111.974 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 12.1 p . . . . . 0 N--CA 1.436 -1.136 0 N-CA-C 108.603 -0.888 . . . . 2.73 108.603 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.454 HG22 ' HG ' ' B' ' 7' ' ' LEU . 3.9 mt -68.86 104.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.701 -0.682 . . . . 2.1699999999999999 110.33 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -83.16 104.6 13.47 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.836 -0.62 . . . . 2.5299999999999998 110.486 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.454 ' HG ' HG22 ' B' ' 5' ' ' ILE . 96.7 mt . . . . . 0 C--N 1.317 -0.83 0 CA-C-O 121.238 0.542 . . . . 2.3199999999999998 109.678 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.9 mm . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.787 0.327 . . . . 2.2400000000000002 110.736 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.638 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -97.69 123.37 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 3.7000000000000002 110.678 179.201 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' A' ' 36' ' ' PHE . 70.8 mt -110.58 118.2 35.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.871 -0.604 . . . . 1.77 109.517 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -80.83 109.32 15.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.905 0.383 . . . . 3.1299999999999999 110.631 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.1 t -81.02 115.46 23.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.734 -0.666 . . . . 1.76 109.999 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.5 mm -107.3 126.97 63.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.031 -0.531 . . . . 2.6000000000000001 110.707 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.57 172.32 21.9 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.797 -0.716 . . . . 2.6400000000000001 111.855 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -64.72 -23.07 67.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.163 0.506 . . . . 3.73 111.113 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.71 15.87 5.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.214 -0.448 . . . . 3.2400000000000002 110.634 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.5 m 61.92 37.01 15.48 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.958 -0.565 . . . . 3.29 111.036 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -86.39 152.14 22.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.856 -0.611 . . . . 2.5 110.798 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -125.99 115.64 20.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.266 -0.424 . . . . 3.0099999999999998 110.323 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -125.97 139.38 51.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.51 -0.552 . . . . 2.3199999999999998 109.51 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.463 ' HB3' HG13 ' B' ' 4' ' ' VAL . 10.5 m170 -88.54 158.44 18.3 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.184 0.516 . . . . 2.3999999999999999 111.176 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.638 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.05 120.12 12.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.279 -0.419 . . . . 1.9399999999999999 110.765 -179.365 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.405 ' CB ' HG11 ' B' ' 4' ' ' VAL . 5.2 mtmt -100.02 96.87 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.664 0.268 . . . . 3.0099999999999998 110.376 179.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 m -113.8 162.66 11.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.896 0.379 . . . . 2.0800000000000001 110.945 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.5 tttt -128.28 141.43 51.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.189 -0.46 . . . . 3.6299999999999999 109.899 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.43 ' C ' ' HG1' ' A' ' 41' ' ' THR . 30.6 ttm -78.09 84.99 4.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.303 0.573 . . . . 3.4100000000000001 110.331 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.43 ' HG1' ' C ' ' A' ' 40' ' ' MET . 16.2 m -163.74 -46.32 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.327 -0.852 . . . . 2.5099999999999998 109.115 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.69 149.07 22.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.296 -0.865 . . . . 2.0 111.507 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -63.93 152.59 39.5 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.27 -0.423 . . . . 2.96 110.42 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.7 mt -67.82 -11.86 59.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.766 0.317 . . . . 2.3799999999999999 111.177 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.446 ' HG3' ' N ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -65.85 -30.71 71.37 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.343 -0.614 . . . . 2.7599999999999998 109.343 178.64 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.446 ' N ' ' HG3' ' A' ' 45' ' ' LYS . 42.4 tptt -68.88 -32.73 72.6 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.5 -0.773 . . . . 2.54 109.074 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.476 ' HA ' ' CD1' ' B' ' 7' ' ' LEU . 0.5 OUTLIER -68.81 -41.69 78.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.195 -0.911 . . . . 2.9900000000000002 110.043 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -64.5 -51.78 61.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.464 -0.789 . . . . 2.3900000000000001 111.834 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.6 pt-20 -66.29 -43.64 85.75 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.302 0.482 . . . . 1.8799999999999999 112.302 -178.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.429 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 50.3 m -61.46 -36.58 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 122.4 -0.187 . . . . 1.72 111.384 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -68.88 -38.54 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.822 -0.436 . . . . 1.8899999999999999 109.822 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 75.4 m -63.13 -42.27 99.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 1.99 109.698 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.429 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.7 mt-30 -64.99 -35.62 81.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.853 -0.612 . . . . 2.1699999999999999 110.2 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.08 -42.45 80.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.744 -0.662 . . . . 2.4900000000000002 110.778 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -79.23 -11.81 59.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 2.4100000000000001 111.332 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.5 31.67 44.93 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.014 -0.612 . . . . 2.7400000000000002 112.632 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.9 m -121.78 156.53 58.93 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 122.892 -0.181 . . . . 2.9399999999999999 110.731 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -69.54 159.99 51.45 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.642 2.228 . . . . 3.0899999999999999 112.103 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.8 145.58 53.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.234 -0.439 . . . . 2.5899999999999999 111.16 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 71.64 16.81 5.7 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.702 0.801 . . . . 3.7599999999999998 112.541 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.2 p -92.42 -27.6 17.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.461 0.648 . . . . 3.0800000000000001 109.611 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.3 mt -111.66 141.75 44.86 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.21 -0.904 . . . . 2.77 110.245 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.453 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 11.4 ptt180 -107.92 118.95 38.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.546 -0.539 . . . . 3.5800000000000001 109.546 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.04 124.81 35.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.619 -0.719 . . . . 2.3999999999999999 109.748 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.7 mt -114.34 136.7 52.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.335 0.588 . . . . 3.6400000000000001 112.052 -178.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -129.94 107.47 9.39 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.741 -1.118 . . . . 2.9700000000000002 108.521 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 61.27 35.23 18.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.979 -0.555 . . . . 3.6400000000000001 110.982 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.3 -5.42 84.42 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.865 -0.607 . . . . 3.7999999999999998 113.202 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -104.48 148.0 26.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.152 -0.314 . . . . 5.0899999999999999 110.152 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 70' ' ' ARG . 12.4 ptm180 -85.94 139.47 31.18 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.43 -0.508 . . . . 3.71 110.476 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 37.4 mm -75.27 113.82 14.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.839 -0.619 . . . . 2.5499999999999998 111.403 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.13 161.42 22.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.161 -0.472 . . . . 3.3799999999999999 110.047 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.5 -23.82 58.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.252 -0.431 . . . . 2.5899999999999999 110.971 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -90.56 3.17 54.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.307 -0.406 . . . . 3.4500000000000002 110.82 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -85.14 147.08 26.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 3.6200000000000001 110.512 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 40.1 p -126.11 160.93 54.69 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.077 -0.511 . . . . 2.9900000000000002 110.14 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.37 -7.92 21.54 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.503 2.135 . . . . 2.21 112.023 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -76.23 -31.34 58.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.829 -0.623 . . . . 3.3500000000000001 110.365 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.4 pt-20 -102.33 -171.01 1.89 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 3.1800000000000002 110.355 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 62.2 mt 72.72 -36.24 0.35 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.523 0.729 . . . . 3.2999999999999998 111.924 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 104.65 35.02 3.38 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.944 -0.646 . . . . 2.8799999999999999 111.856 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.1 mtt -70.12 129.1 38.5 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.913 0.387 . . . . 2.7000000000000002 111.091 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -126.76 176.27 7.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.054 -0.521 . . . . 3.4399999999999999 110.17 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -64.23 142.71 58.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.182 -0.463 . . . . 2.3399999999999999 110.398 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 54.66 50.68 15.36 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.672 0.608 . . . . 2.6299999999999999 111.221 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.68 -175.61 4.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.418 -0.356 . . . . 2.2799999999999998 110.366 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.95 138.67 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 2.6699999999999999 111.407 -178.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.477 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 14.9 tt -137.11 132.27 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.146 -0.687 . . . . 2.0800000000000001 109.146 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -104.36 146.21 29.15 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.596 0.236 . . . . 2.8999999999999999 110.663 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p -131.47 129.95 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.046 0.45 . . . . 2.3599999999999999 110.431 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -134.68 162.79 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.035 -0.53 . . . . 3.0 110.135 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -83.9 135.6 34.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.602 -0.272 . . . . 3.8100000000000001 110.852 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.453 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 7.1 mm-40 -77.19 146.91 36.75 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.113 -0.328 . . . . 3.6099999999999999 110.113 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -68.13 -26.0 65.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.868 0.366 . . . . 5.0499999999999998 110.792 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -35.19 79.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.15 -0.477 . . . . 4.6799999999999997 111.125 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.11 -37.65 3.37 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.886 -0.673 . . . . 3.7999999999999998 112.203 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.909 0 CA-C-O 118.7 -1.056 . . . . 3.6800000000000002 111.762 179.904 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.463 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.664 0.268 . . . . 2.73 110.853 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.407 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 13.7 mt -69.72 115.98 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.479 -0.563 . . . . 2.1699999999999999 109.479 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . 0.434 ' O ' HD23 ' B' ' 7' ' ' LEU . 20.4 m-20 -72.27 106.13 4.32 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 116.665 -0.243 . . . . 2.5299999999999998 110.948 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.476 ' CD1' ' HA ' ' A' ' 47' ' ' LEU . 11.2 mt . . . . . 0 C--N 1.318 -0.794 0 N-CA-C 109.682 -0.488 . . . . 2.3199999999999998 109.682 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.407 HG21 ' HA ' ' A' ' 84' ' ' GLU . 32.3 mm . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 109.869 -0.419 . . . . 2.2400000000000002 109.869 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.555 ' HE3' ' CD2' ' A' ' 35' ' ' HIS . 9.6 ttpt -98.62 119.34 37.18 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.352 -0.385 . . . . 3.7000000000000002 110.462 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 85.5 mt -101.58 142.18 33.34 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.929 -0.578 . . . . 1.77 110.012 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -97.69 103.08 14.99 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.798 -0.445 . . . . 3.1299999999999999 109.798 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.9 t -82.37 116.08 25.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.108 -0.497 . . . . 1.76 110.045 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.523 ' HA ' ' O ' ' A' ' 32' ' ' SER . 38.1 mm -108.16 123.25 63.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.928 -0.578 . . . . 2.6000000000000001 111.159 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.72 177.93 32.09 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.73 -0.748 . . . . 2.6400000000000001 111.591 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -69.0 -20.47 64.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.237 0.542 . . . . 3.73 110.471 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -86.18 11.7 11.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.58 -0.736 . . . . 3.2400000000000002 110.343 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.1 m 62.0 34.11 16.87 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.394 -0.821 . . . . 3.29 111.968 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.523 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 29.1 p -92.57 150.19 20.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.318 -0.623 . . . . 2.5 109.318 178.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -124.36 112.77 17.35 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.977 -0.379 . . . . 3.0099999999999998 109.977 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 15.8 mm -111.96 142.78 23.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.791 -0.448 . . . . 2.3199999999999998 109.791 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.555 ' CD2' ' HE3' ' A' ' 23' ' ' LYS . 47.5 m170 -91.35 140.26 29.94 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.923 0.392 . . . . 2.3999999999999999 110.17 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.533 ' CE1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -131.67 121.69 24.7 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.332 0.493 . . . . 1.9399999999999999 112.332 -178.385 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.5 ' HE3' ' HB ' ' B' ' 4' ' ' VAL . 32.0 mttt -81.39 99.46 8.71 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.557 -0.292 . . . . 3.0099999999999998 110.474 177.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.7 p -115.53 163.7 12.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.983 0.42 . . . . 2.0800000000000001 111.06 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.32 144.06 46.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.419 -0.355 . . . . 3.6299999999999999 110.154 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.6 84.67 7.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.223 0.535 . . . . 3.4100000000000001 109.744 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -166.8 -60.31 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.653 -0.869 . . . . 2.5099999999999998 108.653 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.7 m -76.45 148.46 37.24 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.919 -1.037 . . . . 2.0 110.304 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -62.12 156.73 20.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.001 0.429 . . . . 2.96 111.145 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.09 -5.41 35.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.038 -0.528 . . . . 2.3799999999999999 110.588 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -61.9 -42.91 99.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.496 -0.774 . . . . 2.7599999999999998 109.182 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -61.94 -39.3 91.63 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.584 -0.735 . . . . 2.54 109.628 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -38.39 81.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.293 -0.867 . . . . 2.9900000000000002 110.184 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -73.05 -52.63 13.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.71 . . . . 2.3900000000000001 112.512 -178.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 10.0 pt-20 -67.66 -44.31 78.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.936 0.717 . . . . 1.8799999999999999 112.936 -177.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.0 m -59.16 -34.94 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.794 0.331 . . . . 1.72 111.172 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.401 ' HD1' ' CE2' ' A' ' 36' ' ' PHE . 27.9 t80 -66.38 -44.1 84.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.048 0.451 . . . . 1.8899999999999999 109.818 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 58.0 m -61.66 -33.92 74.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.425 -0.807 . . . . 1.99 110.79 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 97.5 mt-30 -63.31 -40.37 97.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 2.1699999999999999 110.975 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 -74.07 -33.53 63.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 2.4900000000000002 110.619 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -79.79 -8.34 59.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.993 0.425 . . . . 2.4100000000000001 110.77 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.79 36.06 66.23 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.998 -0.546 . . . . 2.7400000000000002 113.14 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 8.0 m -131.88 149.85 74.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 O-C-N 122.621 -0.34 . . . . 2.9399999999999999 110.698 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -65.84 156.57 63.51 Favored 'Trans proline' 0 N--CA 1.464 -0.206 0 C-N-CA 122.493 2.129 . . . . 3.0899999999999999 111.626 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.505 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 20.3 ttt -69.82 152.98 43.94 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 121.109 -0.236 . . . . 2.5899999999999999 110.426 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.9 m120 78.96 -0.19 2.39 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.618 0.767 . . . . 3.7599999999999998 112.076 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.3 p -83.68 -24.67 31.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.65 0.738 . . . . 3.0800000000000001 109.131 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -120.61 145.39 47.43 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.911 -1.04 . . . . 2.77 109.836 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.7 ptt-85 -112.33 138.82 48.5 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.043 -0.526 . . . . 3.5800000000000001 109.787 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.401 ' HA ' ' O ' ' A' ' 89' ' ' GLU . 49.2 m-85 -107.0 128.26 54.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.482 -0.562 . . . . 2.3999999999999999 109.482 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.7 mp -116.14 134.42 54.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.226 0.536 . . . . 3.6400000000000001 112.05 -178.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.402 ' HE1' ' OD1' ' A' ' 86' ' ' ASP . 65.2 t80 -129.63 115.56 17.56 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.354 -0.839 . . . . 2.9700000000000002 109.016 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.39 26.32 15.71 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.818 -0.628 . . . . 3.6400000000000001 111.391 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.64 -20.73 49.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.985 -0.626 . . . . 3.7999999999999998 113.426 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -99.79 138.68 36.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.955 0.377 . . . . 5.0899999999999999 110.631 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -75.46 135.85 40.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.331 0.586 . . . . 3.71 110.469 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 36.9 mm -71.05 126.44 31.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.327 -0.851 . . . . 2.5499999999999998 111.86 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -91.98 162.59 14.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.668 -0.696 . . . . 3.3799999999999999 109.729 178.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -72.92 -24.96 60.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.85 0.357 . . . . 2.5899999999999999 111.406 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -87.95 3.61 48.0 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.86 0.362 . . . . 3.4500000000000002 110.755 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.45 ' HD1' HD13 ' A' ' 80' ' ' LEU . 13.9 m170 -86.48 152.21 22.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.008 0.432 . . . . 3.6200000000000001 111.013 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.491 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 20.6 p -129.97 161.77 57.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.612 -0.722 . . . . 2.9900000000000002 109.8 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -69.13 -13.22 35.86 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.389 2.059 . . . . 2.21 111.765 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -74.0 -34.6 64.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.764 -0.653 . . . . 3.3500000000000001 110.418 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.3 pt-20 -91.84 175.88 6.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.43 -0.581 . . . . 3.1800000000000002 109.43 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.45 HD13 ' HD1' ' A' ' 75' ' ' HIS . 24.1 mt 72.04 -29.96 0.2 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.091 0.556 . . . . 3.2999999999999998 111.845 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.474 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 95.64 36.82 5.21 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.977 -0.63 . . . . 2.8799999999999999 112.181 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 50.2 mtp -73.68 131.24 41.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.765 -0.457 . . . . 2.7000000000000002 109.765 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -125.37 -169.06 1.93 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.741 0.305 . . . . 3.4399999999999999 111.32 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.407 ' HA ' HG21 ' A' ' 22' ' ' ILE . 9.9 tp10 -71.06 142.83 50.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.986 -0.552 . . . . 2.3399999999999999 110.606 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 59.8 32.25 21.23 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 123.548 0.53 . . . . 2.6299999999999999 111.223 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.402 ' OD1' ' HE1' ' A' ' 66' ' ' PHE . 1.1 t0 -76.53 171.01 15.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 2.2799999999999998 110.628 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.6 t -118.08 140.34 41.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.084 0.469 . . . . 2.6699999999999999 111.707 -178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.51 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.1 tt -139.0 127.64 28.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.149 -0.686 . . . . 2.0800000000000001 109.149 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.401 ' O ' ' HA ' ' A' ' 64' ' ' PHE . 44.5 mt-10 -94.8 149.29 21.4 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.651 0.263 . . . . 2.8999999999999999 111.564 -178.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -130.5 125.66 59.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.131 -0.486 . . . . 2.3599999999999999 110.241 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -132.56 161.54 33.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.308 -0.405 . . . . 3.0 110.515 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -86.92 130.93 34.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.806 0.336 . . . . 3.8100000000000001 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.73 140.16 42.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.488 -0.324 . . . . 3.6099999999999999 110.17 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -56.56 -36.28 69.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.945 -0.57 . . . . 5.0499999999999998 111.156 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.34 -29.54 70.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.114 -0.494 . . . . 4.6799999999999997 111.847 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.09 -1.04 86.43 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.06 -0.591 . . . . 3.7999999999999998 112.586 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.692 -1.06 . . . . 3.6800000000000002 111.833 179.89 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.5 ' HB ' ' HE3' ' A' ' 37' ' ' LYS . 1.6 t . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 109.759 -0.459 . . . . 2.73 109.759 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.533 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 21.4 mt -68.64 118.47 12.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.725 -0.472 . . . . 2.1699999999999999 109.725 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -76.51 121.34 22.99 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.871 -0.604 . . . . 2.5299999999999998 111.31 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mp . . . . . 0 C--N 1.32 -0.699 0 CA-C-O 121.506 0.67 . . . . 2.3199999999999998 109.4 178.131 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.9 mm . . . . . 0 CA--C 1.523 -0.079 0 CA-C-O 121.059 0.457 . . . . 2.2400000000000002 111.574 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.546 ' HZ2' ' HB3' ' A' ' 23' ' ' LYS . 4.3 ttpm? -110.45 118.79 37.2 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.083 -0.508 . . . . 3.7000000000000002 109.726 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -101.52 150.41 23.09 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.92 -0.582 . . . . 1.77 110.641 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HE3' ' NE2' ' A' ' 35' ' ' HIS . 31.9 mtpt -103.42 110.48 22.51 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.411 -0.589 . . . . 3.1299999999999999 109.411 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.1 t -88.46 125.13 41.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.262 -0.426 . . . . 1.76 110.517 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.543 ' HA ' ' O ' ' A' ' 32' ' ' SER . 35.2 mm -113.31 123.88 69.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.935 -0.575 . . . . 2.6000000000000001 110.625 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.38 177.53 40.95 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.937 -0.649 . . . . 2.6400000000000001 111.874 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -69.5 -27.76 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.571 0.185 . . . . 3.73 111.31 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -88.7 26.5 1.49 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.752 0.31 . . . . 3.2400000000000002 110.954 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m 61.64 34.77 17.45 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.316 0.579 . . . . 3.29 110.793 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.543 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -84.45 149.02 26.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.764 -0.653 . . . . 2.5 110.343 -179.714 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -131.43 120.04 22.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.183 -0.462 . . . . 3.0099999999999998 110.192 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.8 mm -131.55 139.47 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.359 -0.608 . . . . 2.3199999999999998 109.359 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.551 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 20.2 m170 -89.49 140.22 29.75 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.473 -0.566 . . . . 2.3999999999999999 109.473 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.549 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -127.93 106.55 9.17 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.537 -0.301 . . . . 1.9399999999999999 111.091 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 ttmt -79.26 103.49 9.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.116 -0.493 . . . . 3.0099999999999998 109.714 178.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 m -109.38 159.65 8.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.043 0.449 . . . . 2.0800000000000001 111.215 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -104.58 126.28 51.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.058 -0.519 . . . . 3.6299999999999999 109.94 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 57.2 ttp -76.57 84.71 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.102 -0.703 . . . . 3.4100000000000001 109.102 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.3 m 168.52 -36.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.5099999999999998 108.132 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.5 m -76.26 145.56 39.59 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.168 -0.924 . . . . 2.0 110.603 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -69.76 148.52 49.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.398 -0.365 . . . . 2.96 110.723 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -66.36 -15.07 62.99 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 2.3799999999999999 111.329 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 8.6 tptt -60.03 -39.55 86.26 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.528 -0.545 . . . . 2.7599999999999998 109.528 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -61.45 -42.62 99.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.195 -0.911 . . . . 2.54 110.683 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.49 -40.9 89.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.947 -0.569 . . . . 2.9900000000000002 110.49 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -64.15 -51.07 65.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 2.3900000000000001 112.251 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -63.08 -47.69 81.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.269 0.47 . . . . 1.8799999999999999 112.269 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.52 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.9 m -65.13 -32.48 74.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.818 0.303 . . . . 1.72 111.818 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.06 -40.21 90.71 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.018 -0.734 . . . . 1.8899999999999999 109.018 179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 74.4 m -64.39 -38.05 89.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.647 -0.706 . . . . 1.99 109.493 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.52 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 91.1 mt-30 -64.12 -41.39 97.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.772 -0.649 . . . . 2.1699999999999999 110.281 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.425 ' NH1' HG12 ' B' ' 5' ' ' ILE . 26.9 ttt180 -67.65 -38.76 84.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.463 -0.335 . . . . 2.4900000000000002 111.012 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -79.58 -9.92 59.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.53 -0.305 . . . . 2.4100000000000001 111.293 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.09 36.97 56.23 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 121.111 -0.566 . . . . 2.7400000000000002 112.496 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.74 151.55 71.03 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 110.482 -0.192 . . . . 2.9399999999999999 110.482 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -67.07 157.91 59.44 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.844 2.363 . . . . 3.0899999999999999 111.729 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.448 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 16.3 tpt -64.13 143.31 57.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.543 -0.299 . . . . 2.5899999999999999 111.055 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.448 ' HB2' ' O ' ' A' ' 59' ' ' MET . 5.0 m120 75.48 1.4 3.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.057 0.762 . . . . 3.7599999999999998 113.057 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.4 p -74.71 -26.48 59.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.238 0.542 . . . . 3.0800000000000001 109.683 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 44.6 mt -119.11 150.11 40.56 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.386 -0.825 . . . . 2.77 110.148 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.0 ptt-85 -113.06 142.13 46.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.005 -0.543 . . . . 3.5800000000000001 109.658 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -108.48 114.4 28.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.214 -0.448 . . . . 2.3999999999999999 109.805 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.6 mt -106.39 123.58 48.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.116 0.484 . . . . 3.6400000000000001 111.406 -178.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -124.5 111.43 15.69 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.679 -0.691 . . . . 2.9700000000000002 109.281 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 61.86 24.56 14.64 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.094 -0.503 . . . . 3.6400000000000001 111.347 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.68 73.56 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.551 -0.833 . . . . 3.7999999999999998 112.401 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -105.41 134.13 49.03 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.786 -0.449 . . . . 5.0899999999999999 109.786 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.09 131.2 37.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.325 0.584 . . . . 3.71 110.025 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.2 mm -68.24 111.47 2.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.536 -0.756 . . . . 2.5499999999999998 111.356 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.51 157.11 24.95 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.144 -0.48 . . . . 3.3799999999999999 110.348 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.409 ' CG ' ' HD3' ' A' ' 45' ' ' LYS . 85.3 m-20 -67.24 -26.34 66.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.114 -0.494 . . . . 2.5899999999999999 111.491 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -93.73 11.81 27.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.348 -0.387 . . . . 3.4500000000000002 111.46 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -91.49 157.02 17.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.123 0.487 . . . . 3.6200000000000001 110.832 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.56 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -137.48 157.76 73.32 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 2.9900000000000002 110.256 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.91 -19.35 61.99 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.696 2.264 . . . . 2.21 112.636 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -64.63 -35.94 82.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.905 0.383 . . . . 3.3500000000000001 110.888 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.5 pt-20 -94.99 176.88 6.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 3.1800000000000002 110.295 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 81.3 mt 70.13 -9.37 0.74 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.071 0.548 . . . . 3.2999999999999998 111.906 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 71.1 44.42 54.25 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.923 -0.656 . . . . 2.8799999999999999 111.99 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -70.56 138.62 51.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.505 0.193 . . . . 2.7000000000000002 110.628 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 42.0 mt-10 -127.42 170.12 12.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.797 0.332 . . . . 3.4399999999999999 110.619 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 20.8 tp10 -69.47 140.9 54.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.912 -0.586 . . . . 2.3399999999999999 109.473 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 31.5 mm-40 70.11 19.87 6.59 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.526 0.516 . . . . 2.6299999999999999 111.261 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.7 OUTLIER -73.82 160.94 30.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.975 -0.38 . . . . 2.2799999999999998 109.975 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 82.5 t -108.44 131.35 59.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.045 0.45 . . . . 2.6699999999999999 111.99 -178.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.2 tt -126.0 131.69 71.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.669 -0.863 . . . . 2.0800000000000001 108.669 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -102.88 137.54 40.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.813 0.339 . . . . 2.8999999999999999 111.7 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 5.4 p -121.2 126.61 75.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 2.3599999999999999 110.295 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -132.64 160.87 35.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.638 0.256 . . . . 3.0 111.081 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -81.07 135.53 35.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.264 -0.425 . . . . 3.8100000000000001 110.948 -179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -84.08 148.11 27.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.229 -0.441 . . . . 3.6099999999999999 109.952 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -66.94 -25.92 66.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.423 -0.353 . . . . 5.0499999999999998 111.655 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.27 -33.19 65.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.713 0.292 . . . . 4.6799999999999997 111.455 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.79 5.73 87.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.766 -0.73 . . . . 3.7999999999999998 112.024 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.868 0 CA-C-O 118.875 -0.958 . . . . 3.6800000000000002 111.91 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.551 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 10.4 p . . . . . 0 N--CA 1.446 -0.659 0 CA-C-O 121.279 0.561 . . . . 2.73 110.382 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.549 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 5.7 mt -76.38 119.36 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 109.426 -0.583 . . . . 2.1699999999999999 109.426 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -83.54 105.93 14.86 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 120.676 0.274 . . . . 2.5299999999999998 110.617 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.464 HD22 ' CB ' ' A' ' 50' ' ' SER . 0.4 OUTLIER . . . . . 0 C--N 1.315 -0.897 0 CA-C-O 121.138 0.494 . . . . 2.3199999999999998 110.657 179.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.1 mm . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 109.428 -0.582 . . . . 2.2400000000000002 109.428 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -93.47 118.66 31.6 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.063 0.459 . . . . 3.7000000000000002 110.938 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 94.0 mt -104.49 150.61 24.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.717 -0.674 . . . . 1.77 109.691 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -113.65 113.22 24.73 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.031 0.443 . . . . 3.1299999999999999 111.592 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.401 HG22 ' CG2' ' A' ' 88' ' ' ILE . 60.4 t -96.44 119.37 44.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.22 -0.659 . . . . 1.76 109.22 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.519 ' HA ' ' O ' ' A' ' 32' ' ' SER . 25.1 mm -100.62 120.39 50.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 2.6000000000000001 111.555 -178.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.61 171.0 42.92 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.263 -0.735 . . . . 2.6400000000000001 111.263 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.5 tp60 -69.58 -22.82 63.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.126 0.489 . . . . 3.73 110.867 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -85.85 15.26 5.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.977 -0.556 . . . . 3.2400000000000002 110.995 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 65.51 47.31 2.28 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.231 0.539 . . . . 3.29 111.43 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.519 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 13.3 p -111.6 136.06 51.33 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.351 -0.611 . . . . 2.5 109.351 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -115.6 94.96 4.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.992 0.425 . . . . 3.0099999999999998 110.559 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.5 mt -91.07 138.56 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.166 -0.47 . . . . 2.3199999999999998 110.235 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.631 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 33.4 m80 -92.12 138.74 31.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.88 -0.6 . . . . 2.3999999999999999 111.775 -178.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.423 ' HZ ' ' CD1' ' A' ' 51' ' ' TYR . 4.4 m-85 -126.17 106.69 9.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.795 -0.639 . . . . 1.9399999999999999 109.995 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' ASP . 23.9 mtmt -85.29 96.84 9.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.217 0.532 . . . . 3.0099999999999998 110.89 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.8 m -106.58 171.2 2.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.761 -0.654 . . . . 2.0800000000000001 110.785 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -128.06 141.17 51.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.32 -0.622 . . . . 3.6299999999999999 109.32 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 ttp -77.64 84.9 3.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.387 0.613 . . . . 3.4100000000000001 109.789 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 48.3 m -164.88 -51.59 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.92 -1.036 . . . . 2.5099999999999998 108.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.34 148.61 32.01 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.825 -1.079 . . . . 2.0 110.313 179.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -67.4 159.16 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.258 -0.428 . . . . 2.96 110.616 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.9 mt -69.29 -11.88 61.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.249 0.547 . . . . 2.3799999999999999 109.71 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.46 72.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.198 -0.91 . . . . 2.7599999999999998 109.216 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.5 tptt -60.31 -43.42 96.34 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.102 -0.954 . . . . 2.54 110.928 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.8 tt -64.8 -33.48 76.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.063 0.458 . . . . 2.9900000000000002 111.044 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -74.45 -36.7 63.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 2.3900000000000001 112.002 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 0.1 OUTLIER -82.24 -45.82 14.53 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.61 0.596 . . . . 1.8799999999999999 112.61 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 p -58.8 -45.53 89.66 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.328 0.492 . . . . 1.72 112.328 -178.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.423 ' CD1' ' HZ ' ' A' ' 36' ' ' PHE . 6.9 t80 -64.33 -36.2 83.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.72 -0.392 . . . . 1.8899999999999999 111.39 -179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.7 m -61.22 -39.42 90.19 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.091 0.472 . . . . 1.99 109.948 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -63.88 -44.28 93.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.744 . . . . 2.1699999999999999 110.391 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.72 -42.21 91.34 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.973 -0.558 . . . . 2.4900000000000002 110.837 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -69.2 -26.86 65.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.506 -0.315 . . . . 2.4100000000000001 110.903 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.61 33.18 10.4 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.8 -0.714 . . . . 2.7400000000000002 111.84 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 m -133.01 154.3 81.3 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.745 0.307 . . . . 2.9399999999999999 110.5 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.69 149.86 73.82 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.56 2.173 . . . . 3.0899999999999999 111.722 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.525 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 23.1 ttt -68.64 161.66 27.65 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.504 -0.317 . . . . 2.5899999999999999 110.242 179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 59' ' ' MET . 11.3 m120 78.53 -12.09 1.13 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.512 0.725 . . . . 3.7599999999999998 111.589 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -78.3 -31.24 48.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.341 0.591 . . . . 3.0800000000000001 109.515 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -108.84 131.66 54.77 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.438 -0.801 . . . . 2.77 110.1 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptt-85 -107.99 122.92 47.84 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 3.5800000000000001 110.086 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -88.3 125.11 34.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.964 -0.562 . . . . 2.3999999999999999 109.696 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.4 mt -110.06 131.64 54.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.986 -0.552 . . . . 3.6400000000000001 110.862 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -124.81 106.34 9.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.621 -0.718 . . . . 2.9700000000000002 109.291 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 64.35 33.2 11.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 3.6400000000000001 111.054 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.83 -21.07 45.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.815 -0.707 . . . . 3.7999999999999998 113.895 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -103.2 138.71 39.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.263 0.531 . . . . 5.0899999999999999 110.565 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -70.47 148.42 48.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.297 0.57 . . . . 3.71 111.061 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 29.5 mm -85.22 120.88 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.427 -0.806 . . . . 2.5499999999999998 111.533 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.87 156.52 24.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.962 -0.563 . . . . 3.3799999999999999 109.913 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -70.08 -27.03 64.29 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.267 -0.424 . . . . 2.5899999999999999 111.598 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -87.63 1.23 54.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.309 -0.405 . . . . 3.4500000000000002 111.234 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.467 ' HD1' HD13 ' A' ' 80' ' ' LEU . 8.7 m170 -85.16 144.92 27.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.045 0.45 . . . . 3.6200000000000001 110.858 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 41.8 p -120.99 161.63 39.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.709 -0.678 . . . . 2.9900000000000002 109.926 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.81 -3.08 7.5 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.666 2.244 . . . . 2.21 112.479 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -79.64 -35.5 39.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.955 -0.566 . . . . 3.3500000000000001 110.37 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.475 ' C ' ' H ' ' A' ' 81' ' ' GLY . 2.9 pt-20 -94.54 -179.57 4.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.185 -0.462 . . . . 3.1800000000000002 109.992 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.467 HD13 ' HD1' ' A' ' 75' ' ' HIS . 13.6 mt 73.05 -29.54 0.2 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.327 0.651 . . . . 3.2999999999999998 111.776 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 94.06 34.58 6.4 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.363 -0.695 . . . . 2.8799999999999999 111.363 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.2 ttm -65.7 128.76 37.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 2.7000000000000002 110.974 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -121.46 -177.65 3.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.987 -0.551 . . . . 3.4399999999999999 110.635 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -75.59 144.52 41.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.149 -0.478 . . . . 2.3399999999999999 110.275 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 62.1 27.05 16.31 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.582 0.551 . . . . 2.6299999999999999 110.584 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.68 140.64 40.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.544 . . . . 2.2799999999999998 110.602 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.8 t -90.38 127.28 42.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.708 -0.678 . . . . 2.6699999999999999 111.631 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.401 ' CG2' HG22 ' A' ' 26' ' ' VAL . 19.3 tt -125.68 139.97 49.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.61 -0.885 . . . . 2.0800000000000001 108.61 178.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -104.86 157.99 16.83 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.992 0.425 . . . . 2.8999999999999999 111.444 -178.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 p -141.19 121.91 12.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 2.3599999999999999 110.418 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -128.55 161.7 28.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.029 -0.532 . . . . 3.0 109.711 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -92.42 138.41 31.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 3.8100000000000001 110.955 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -72.36 142.67 48.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.892 -0.595 . . . . 3.6099999999999999 110.019 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -66.98 -34.41 77.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.393 -0.367 . . . . 5.0499999999999998 110.597 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -35.52 80.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.019 -0.537 . . . . 4.6799999999999997 111.408 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.24 -27.68 15.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.842 -0.694 . . . . 3.7999999999999998 111.902 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.874 0 CA-C-O 118.88 -0.955 . . . . 3.6800000000000002 111.749 179.745 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.631 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 7.4 p . . . . . 0 N--CA 1.441 -0.89 0 N-CA-C 109.278 -0.638 . . . . 2.73 109.278 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -90.58 109.61 21.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.829 -0.623 . . . . 2.1699999999999999 110.757 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . 0.422 ' HA ' ' O ' ' A' ' 37' ' ' LYS . 1.8 m-20 -76.46 117.95 18.64 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 116.058 -0.519 . . . . 2.5299999999999998 109.757 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 13.1 mt . . . . . 0 C--N 1.313 -0.997 0 CA-C-O 121.45 0.643 . . . . 2.3199999999999998 110.033 179.94 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.3 mm . . . . . 0 CA--C 1.52 -0.204 0 N-CA-C 110.118 -0.327 . . . . 2.2400000000000002 110.118 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 tttt -103.39 119.76 39.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.164 0.507 . . . . 3.7000000000000002 111.364 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.0 mt -106.33 150.25 26.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.561 -0.745 . . . . 1.77 109.537 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -104.74 106.57 17.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.432 -0.349 . . . . 3.1299999999999999 110.581 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.01 123.02 37.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.202 -0.666 . . . . 1.76 109.202 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 89' ' ' GLU . 48.1 mm -117.92 108.57 24.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.013 0.435 . . . . 2.6000000000000001 110.625 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.28 170.13 50.42 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.582 -0.818 . . . . 2.6400000000000001 111.29 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -64.99 -27.69 69.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.14 0.495 . . . . 3.73 110.731 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.516 ' CG ' ' HG ' ' A' ' 32' ' ' SER . 7.2 p-10 -89.15 25.41 1.87 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.686 -0.688 . . . . 3.2400000000000002 111.411 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.8 m 60.11 33.84 21.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.167 0.508 . . . . 3.29 111.839 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.516 ' HG ' ' CG ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER -87.42 114.11 23.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.991 -0.55 . . . . 2.5 109.739 179.151 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -101.37 108.75 20.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.609 -0.515 . . . . 3.0099999999999998 109.609 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.8 mm -115.66 144.43 23.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.567 0.223 . . . . 2.3199999999999998 110.41 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -89.06 141.78 28.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.916 0.389 . . . . 2.3999999999999999 110.391 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.485 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -133.79 104.41 6.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 1.9399999999999999 111.063 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -91.01 106.75 18.74 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.254 0.55 . . . . 3.0099999999999998 110.982 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 18.0 m -111.83 170.46 3.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.689 -0.687 . . . . 2.0800000000000001 111.249 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.472 ' HE2' ' OG1' ' A' ' 42' ' ' THR . 16.1 pttm -119.16 138.67 52.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.989 -0.55 . . . . 3.6299999999999999 109.922 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.461 ' C ' ' HG1' ' A' ' 41' ' ' THR . 42.7 tpp -75.1 84.71 2.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.125 0.488 . . . . 3.4100000000000001 110.141 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.461 ' HG1' ' C ' ' A' ' 40' ' ' MET . 0.5 OUTLIER -166.3 -55.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 2.5099999999999998 109.369 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.472 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 0.8 OUTLIER -79.09 147.64 32.7 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.126 -0.943 . . . . 2.0 110.841 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -70.19 173.51 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.236 -0.653 . . . . 2.96 109.236 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.01 3.89 6.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.246 0.546 . . . . 2.3799999999999999 110.139 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.4 tptt -60.24 -46.2 90.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.102 -0.953 . . . . 2.7599999999999998 109.208 177.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -65.24 -38.48 90.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.888 -1.051 . . . . 2.54 110.037 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.93 -46.15 71.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.815 -0.63 . . . . 2.9900000000000002 110.581 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.421 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 53.7 mtpt -70.05 -54.67 12.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.725 -0.67 . . . . 2.3900000000000001 112.647 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -43.62 79.79 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.198 0.814 . . . . 1.8799999999999999 113.198 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.8 m -63.47 -37.1 86.0 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.327 -0.233 . . . . 1.72 111.537 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -67.17 -43.68 81.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.636 -0.426 . . . . 1.8899999999999999 109.915 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.66 -37.65 82.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.01 0.433 . . . . 1.99 110.303 179.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -60.39 -43.08 96.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.825 -0.625 . . . . 2.1699999999999999 110.518 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.18 -28.78 61.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.326 -0.397 . . . . 2.4900000000000002 110.888 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -74.92 -19.68 60.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.511 -0.313 . . . . 2.4100000000000001 111.184 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.64 25.38 42.5 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.609 -0.805 . . . . 2.7400000000000002 112.288 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 7.0 m -127.73 154.7 77.91 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 110.07 -0.345 . . . . 2.9399999999999999 110.07 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.38 161.91 44.28 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.283 1.988 . . . . 3.0899999999999999 111.771 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.06 153.36 43.9 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.292 -0.413 . . . . 2.5899999999999999 110.664 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t30 74.96 5.97 4.32 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.612 0.765 . . . . 3.7599999999999998 112.069 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.5 p -88.81 -26.01 21.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.263 0.554 . . . . 3.0800000000000001 109.698 178.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -115.5 146.22 41.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.47 -0.786 . . . . 2.77 110.24 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.5 ptt-85 -119.0 133.99 55.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.401 -0.592 . . . . 3.5800000000000001 109.401 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.421 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 96.2 m-85 -102.65 128.05 49.5 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.069 -0.514 . . . . 2.3999999999999999 109.906 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.9 mt -110.35 133.45 53.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.378 0.609 . . . . 3.6400000000000001 111.546 -179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -124.95 105.55 9.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.106 -0.952 . . . . 2.9700000000000002 108.508 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 63.95 22.68 13.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.862 -0.608 . . . . 3.6400000000000001 110.87 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.17 -25.75 26.13 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.973 -0.632 . . . . 3.7999999999999998 112.678 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -87.36 143.07 27.43 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.099 -0.334 . . . . 5.0899999999999999 110.099 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -82.16 140.33 33.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.257 0.551 . . . . 3.71 110.706 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.6 mm -78.56 116.14 21.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.559 -0.746 . . . . 2.5499999999999998 111.082 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.57 26.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.016 -0.538 . . . . 3.3799999999999999 110.39 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.1 m-20 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.227 -0.442 . . . . 2.5899999999999999 111.222 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -92.21 -2.52 56.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.498 -0.319 . . . . 3.4500000000000002 111.68 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.2 m170 -67.35 143.89 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.765 0.317 . . . . 3.6200000000000001 110.877 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 75.6 p -120.27 155.84 55.67 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 116.307 -0.406 . . . . 2.9900000000000002 110.615 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.01 -11.05 28.69 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.39 2.06 . . . . 2.21 111.212 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -78.89 -38.92 36.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.504 -0.771 . . . . 3.3500000000000001 110.274 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 10.0 pt-20 -86.49 -179.15 6.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.462 -0.335 . . . . 3.1800000000000002 110.41 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 9.0 mt 72.07 -54.75 0.68 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.225 0.61 . . . . 3.2999999999999998 111.674 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.85 36.36 0.67 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.673 -0.571 . . . . 2.8799999999999999 111.673 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.07 132.37 45.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.9 0.381 . . . . 2.7000000000000002 110.453 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -124.79 -168.74 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.12 0.486 . . . . 3.4399999999999999 111.485 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -76.24 143.76 40.79 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.518 -0.764 . . . . 2.3399999999999999 109.681 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 60.59 28.12 17.81 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.421 . . . . 2.6299999999999999 110.893 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.92 147.15 43.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 2.2799999999999998 110.153 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 17.6 t -96.09 128.32 47.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.234 0.54 . . . . 2.6699999999999999 111.708 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.8 tt -125.57 112.81 32.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.742 -0.836 . . . . 2.0800000000000001 108.742 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.467 ' HA ' ' O ' ' A' ' 27' ' ' ILE . 75.8 mt-10 -88.64 141.45 28.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.736 -0.666 . . . . 2.8999999999999999 111.181 -178.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.41 137.52 53.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.075 -0.511 . . . . 2.3599999999999999 110.349 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -137.12 163.36 31.01 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.557 -0.534 . . . . 3.0 109.557 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -95.81 139.43 32.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.686 0.279 . . . . 3.8100000000000001 110.48 -179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -79.17 149.34 32.01 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 3.6099999999999999 110.289 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -58.59 -45.5 88.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 5.0499999999999998 110.841 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.7 p -72.05 -32.75 67.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.056 -0.52 . . . . 4.6799999999999997 110.277 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.73 15.04 70.78 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.682 -0.69 . . . . 3.7999999999999998 112.296 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.936 0 N-CA-C 110.922 -0.871 . . . . 3.6800000000000002 110.922 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 N--CA 1.443 -0.776 0 CA-C-O 121.433 0.635 . . . . 2.73 110.94 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.485 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 18.4 mt -87.55 108.52 18.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.828 -0.624 . . . . 2.1699999999999999 109.502 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -79.67 134.42 36.42 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.79 -0.448 . . . . 2.5299999999999998 109.79 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 18.2 mt . . . . . 0 C--N 1.32 -0.68 0 CA-C-O 121.479 0.657 . . . . 2.3199999999999998 109.989 178.141 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.9 mm . . . . . 0 N--CA 1.456 -0.171 0 N-CA-C 109.994 -0.373 . . . . 2.2400000000000002 109.994 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.586 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 35.6 ttpt -112.43 118.59 35.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.442 -0.345 . . . . 3.7000000000000002 110.204 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.3 mt -102.67 150.29 23.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.334 -0.394 . . . . 1.77 110.039 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -107.82 111.45 23.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.782 0.325 . . . . 3.1299999999999999 111.173 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 20.2 t -90.06 104.35 15.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.129 -0.693 . . . . 1.76 109.129 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.76 114.93 30.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.066 0.46 . . . . 2.6000000000000001 111.47 -178.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 170.05 34.56 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.771 -0.65 . . . . 2.6400000000000001 111.949 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -71.85 -16.59 62.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.135 0.493 . . . . 3.73 110.9 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -91.69 15.03 13.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.486 . . . . 3.2400000000000002 110.747 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.9 m 68.14 30.17 5.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.582 -0.735 . . . . 3.29 111.708 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 55.7 p -99.18 140.69 32.96 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.494 -0.558 . . . . 2.5 109.494 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.417 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 5.0 pt-20 -125.71 92.57 3.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.133 0.492 . . . . 3.0099999999999998 110.939 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.448 HG22 HD11 ' A' ' 34' ' ' ILE . 6.6 mm -81.22 139.3 18.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.767 -0.827 . . . . 2.3199999999999998 108.767 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -95.64 147.61 23.4 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.871 -0.332 . . . . 2.3999999999999999 110.32 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.586 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -125.62 117.11 22.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.324 -0.398 . . . . 1.9399999999999999 111.164 -179.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.457 ' N ' HG12 ' B' ' 4' ' ' VAL . 3.6 mtmt -96.68 96.11 8.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.136 0.493 . . . . 3.0099999999999998 110.818 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.2 m -118.29 170.88 7.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.733 . . . . 2.0800000000000001 111.35 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.89 147.0 50.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.932 -0.766 . . . . 3.6299999999999999 108.932 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.638 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 23.1 mmt -69.39 86.2 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.209 0.528 . . . . 3.4100000000000001 110.672 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.1 m -164.53 -52.32 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.529 -0.76 . . . . 2.5099999999999998 109.622 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.05 147.66 34.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.261 -0.881 . . . . 2.0 111.484 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -69.37 165.58 20.46 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.154 -0.475 . . . . 2.96 110.586 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.2 mt -70.99 -9.92 58.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.149 0.499 . . . . 2.3799999999999999 110.564 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.41 ' HG3' ' OD2' ' A' ' 73' ' ' ASP . 40.3 tttp -63.49 -38.01 89.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.236 -0.653 . . . . 2.7599999999999998 109.236 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -61.76 -36.38 80.87 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.316 -0.857 . . . . 2.54 110.218 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.21 -39.52 94.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.603 -0.726 . . . . 2.9900000000000002 110.391 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -70.6 -52.45 21.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.38 -0.827 . . . . 2.3900000000000001 112.206 -178.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.466 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 4.4 pt-20 -65.27 -47.04 78.08 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.884 0.698 . . . . 1.8799999999999999 112.884 -177.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.459 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 13.0 m -59.79 -39.26 84.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.711 0.291 . . . . 1.72 111.777 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -69.28 -41.06 77.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.632 -0.427 . . . . 1.8899999999999999 110.298 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.72 -40.78 96.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.327 -0.397 . . . . 1.99 110.634 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 92.9 mt-30 -62.07 -41.78 98.52 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.226 0.536 . . . . 2.1699999999999999 109.955 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.447 ' NH1' HG12 ' B' ' 5' ' ' ILE . 23.4 ttt180 -64.86 -43.81 91.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.846 -0.615 . . . . 2.4900000000000002 110.573 179.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -69.39 -25.33 64.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 2.4100000000000001 110.466 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.71 40.36 8.28 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 111.224 -0.75 . . . . 2.7400000000000002 111.224 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.4 m -135.99 155.75 77.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.292 . . . . 2.9399999999999999 110.21 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.45 148.46 92.62 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.87 2.38 . . . . 3.0899999999999999 112.126 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.463 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 12.6 ttt -76.44 61.32 1.7 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.498 0.666 . . . . 2.5899999999999999 110.883 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -170.1 -18.36 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.446 -0.797 . . . . 3.7599999999999998 109.735 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 m -82.31 -12.05 58.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 3.0800000000000001 111.583 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 64.2 mt -121.64 139.32 53.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.05 0.453 . . . . 2.77 111.177 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.403 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 19.9 ptt-85 -118.15 129.0 55.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.993 -0.549 . . . . 3.5800000000000001 109.565 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -97.68 126.98 43.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.982 -0.553 . . . . 2.3999999999999999 110.309 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 81.9 mt -113.88 137.12 52.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 3.6400000000000001 110.851 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -127.17 100.38 6.07 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.495 -0.928 . . . . 2.9700000000000002 108.495 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 65.55 31.79 9.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.634 -0.712 . . . . 3.6400000000000001 110.555 -179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.74 -28.04 15.24 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.733 -0.667 . . . . 3.7999999999999998 112.701 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -87.71 135.4 33.39 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.225 -0.287 . . . . 5.0899999999999999 110.225 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -75.56 142.16 42.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.469 0.652 . . . . 3.71 111.328 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 30.3 mm -79.59 117.38 25.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.268 -0.878 . . . . 2.5499999999999998 110.925 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.441 ' HB2' ' ND1' ' A' ' 75' ' ' HIS . . . -84.81 154.9 22.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.048 -0.524 . . . . 3.3799999999999999 110.229 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.41 ' OD2' ' HG3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -66.99 -27.75 67.69 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.993 -0.548 . . . . 2.5899999999999999 111.744 -179.051 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -89.4 4.25 49.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 3.4500000000000002 111.503 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.441 ' ND1' ' HB2' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -86.37 149.16 25.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.336 0.589 . . . . 3.6200000000000001 111.378 -179.35 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.1 p -117.42 157.95 46.11 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.502 -0.772 . . . . 2.9900000000000002 110.09 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . 0.638 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 17.0 Cg_exo -67.0 -10.71 29.54 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.441 2.094 . . . . 2.21 111.952 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -79.46 -17.56 53.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.366 0.603 . . . . 3.3500000000000001 109.79 179.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -98.01 164.14 12.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.661 -0.699 . . . . 3.1800000000000002 110.26 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 86.6 mt 68.68 -1.13 2.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.888 -0.597 . . . . 3.2999999999999998 111.944 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.07 45.53 55.96 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.81 -0.71 . . . . 2.8799999999999999 112.868 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 3.6 ttt -72.53 125.4 27.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.811 0.338 . . . . 2.7000000000000002 110.229 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -114.18 -171.53 1.93 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.467 0.543 . . . . 3.4399999999999999 112.467 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.94 137.45 45.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.499 -0.773 . . . . 2.3399999999999999 110.229 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 54.76 38.7 30.61 Favored 'General case' 0 CA--C 1.516 -0.348 0 O-C-N 123.797 0.686 . . . . 2.6299999999999999 110.863 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.02 160.11 33.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.609 -0.723 . . . . 2.2799999999999998 110.404 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 99.3 t -99.16 114.06 35.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.394 0.616 . . . . 2.6699999999999999 112.208 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -120.32 132.31 70.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 108.277 -1.008 . . . . 2.0800000000000001 108.277 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -111.66 144.05 41.57 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.916 0.389 . . . . 2.8999999999999999 111.28 -178.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.62 129.54 73.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.078 -0.51 . . . . 2.3599999999999999 110.421 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -130.92 159.72 36.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.23 -0.441 . . . . 3.0 110.121 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -79.95 139.59 37.0 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.864 0.364 . . . . 3.8100000000000001 111.026 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.403 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.4 mm-40 -77.38 149.83 35.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.914 -0.585 . . . . 3.6099999999999999 110.855 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -73.17 -32.68 64.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.874 -0.603 . . . . 5.0499999999999998 110.317 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 p -65.18 -57.18 9.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.908 -0.587 . . . . 4.6799999999999997 110.128 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.35 -20.31 18.82 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.756 -0.656 . . . . 3.7999999999999998 112.493 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.75 -1.028 . . . . 3.6800000000000002 111.807 -179.904 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.457 HG12 ' N ' ' A' ' 37' ' ' LYS . 2.2 t . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 109.671 -0.492 . . . . 2.73 109.671 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.469 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 9.6 mt -71.77 108.71 3.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 2.1699999999999999 109.707 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -73.94 107.6 6.26 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 116.157 -0.474 . . . . 2.5299999999999998 110.466 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 C--N 1.314 -0.947 0 C-N-CA 119.455 -0.898 . . . . 2.3199999999999998 109.966 178.665 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm . . . . . 0 C--O 1.232 0.163 0 N-CA-C 109.622 -0.51 . . . . 2.2400000000000002 109.622 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.703 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -102.5 145.84 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.157 0.503 . . . . 3.7000000000000002 111.689 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.0 mt -131.0 128.86 41.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.493 -0.776 . . . . 1.77 109.26 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -93.78 109.91 21.57 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.847 0.356 . . . . 3.1299999999999999 110.464 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 12.4 t -85.55 123.2 39.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.76 110.747 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.6 mm -109.93 116.7 52.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.685 -0.689 . . . . 2.6000000000000001 110.117 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.65 -179.93 43.33 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 2.6400000000000001 112.275 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -65.88 -28.48 68.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 3.73 110.617 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -86.21 13.56 7.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.107 -0.497 . . . . 3.2400000000000002 110.606 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m 59.78 48.63 8.93 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.833 0.825 . . . . 3.29 110.327 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.57 166.42 16.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.954 -1.021 . . . . 2.5 109.815 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -137.53 97.07 3.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.023 0.44 . . . . 3.0099999999999998 110.243 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.7 mm -116.23 127.63 73.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.554 . . . . 2.3199999999999998 109.58 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.521 ' HB3' ' CG1' ' B' ' 4' ' ' VAL . 0.0 OUTLIER -88.81 166.67 13.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.141 0.495 . . . . 2.3999999999999999 110.826 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.703 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -143.39 131.11 21.36 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 122.246 -0.284 . . . . 1.9399999999999999 111.71 -179.062 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -99.09 95.2 6.96 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.061 -0.348 . . . . 3.0099999999999998 110.061 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.9 m -117.35 171.58 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 2.0800000000000001 111.465 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.63 148.35 50.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.542 -0.54 . . . . 3.6299999999999999 109.542 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.477 ' C ' ' HG1' ' A' ' 41' ' ' THR . 26.6 mtt -83.96 85.33 7.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.225 0.536 . . . . 3.4100000000000001 111.032 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.477 ' HG1' ' C ' ' A' ' 40' ' ' MET . 16.3 m -167.74 -46.9 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.294 -1.002 . . . . 2.5099999999999998 108.294 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.52 148.07 37.35 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.716 -1.129 . . . . 2.0 110.882 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -66.67 155.27 38.43 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.295 -0.412 . . . . 2.96 110.648 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.8 mt -69.5 -9.96 56.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.449 . . . . 2.3799999999999999 110.3 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.549 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 17.8 ttpp -61.51 -40.23 93.87 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.486 -0.779 . . . . 2.7599999999999998 109.103 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.3 tptp -62.6 -39.87 95.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.349 -0.841 . . . . 2.54 109.95 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.13 -44.39 87.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 2.9900000000000002 110.201 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -68.88 -54.59 14.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.604 -0.726 . . . . 2.3900000000000001 112.356 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.4 pt-20 -62.67 -42.58 99.69 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.788 0.662 . . . . 1.8799999999999999 112.788 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.494 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 9.4 m -65.67 -34.54 78.45 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.816 -0.354 . . . . 1.72 111.22 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.485 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 7.0 t80 -70.87 -40.69 72.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.525 -0.546 . . . . 1.8899999999999999 109.525 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 79.8 m -61.5 -35.22 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 1.99 109.896 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.494 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 72.8 mt-30 -63.44 -38.12 89.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.69 -0.686 . . . . 2.1699999999999999 110.363 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.437 ' NH1' HG12 ' B' ' 5' ' ' ILE . 2.4 ttt180 -76.05 -38.45 57.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.367 -0.379 . . . . 2.4900000000000002 110.334 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 10.8 mm100 -69.61 -22.79 63.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.063 0.459 . . . . 2.4100000000000001 110.251 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.28 27.24 40.69 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.005 -0.617 . . . . 2.7400000000000002 112.506 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.2 m -117.56 153.13 50.36 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.547 0.213 . . . . 2.9399999999999999 110.814 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.79 173.97 11.1 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.399 2.066 . . . . 3.0899999999999999 111.836 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.4 tpt -74.57 148.94 40.37 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.649 -0.25 . . . . 2.5899999999999999 110.753 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 70.06 16.72 7.48 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.636 -0.711 . . . . 3.7599999999999998 112.167 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.5 p -92.42 -26.62 17.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.242 0.544 . . . . 3.0800000000000001 109.698 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.7 mt -121.22 146.28 46.96 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.579 -0.737 . . . . 2.77 110.227 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.44 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.5 ptt-85 -119.3 131.26 55.72 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.142 -0.688 . . . . 3.5800000000000001 109.142 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.1 m-85 -99.87 133.83 43.66 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.964 -0.562 . . . . 2.3999999999999999 110.675 -178.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.7 mt -115.89 131.74 56.85 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.961 -0.563 . . . . 3.6400000000000001 110.665 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -134.97 114.49 12.55 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.424 -0.807 . . . . 2.9700000000000002 109.069 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 62.98 23.2 13.89 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.09 0.472 . . . . 3.6400000000000001 110.798 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.42 -12.55 68.74 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.953 -0.642 . . . . 3.7999999999999998 112.452 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -103.51 138.48 40.16 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.663 -0.316 . . . . 5.0899999999999999 110.279 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.2 ptm180 -76.28 142.37 41.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.136 0.493 . . . . 3.71 110.476 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.3 mm -75.75 117.8 20.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.798 -0.637 . . . . 2.5499999999999998 111.811 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.32 157.39 18.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.663 -0.698 . . . . 3.3799999999999999 109.64 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -67.85 -29.08 68.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.317 0.58 . . . . 2.5899999999999999 110.629 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -82.73 -4.42 57.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.697 -0.683 . . . . 3.4500000000000002 111.177 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -81.76 145.46 30.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.105 0.479 . . . . 3.6200000000000001 111.058 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.419 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 21.1 p -127.47 161.07 56.98 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 2.9900000000000002 109.7 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -65.39 -11.5 30.55 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.367 2.045 . . . . 2.21 111.923 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.41 -36.17 71.24 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.829 -0.623 . . . . 3.3500000000000001 110.313 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 4.2 pt-20 -97.95 -178.68 4.16 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.433 -0.581 . . . . 3.1800000000000002 109.433 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 23.7 mt 73.92 -49.94 0.68 Allowed 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.666 0.604 . . . . 3.2999999999999998 110.896 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.06 50.74 0.62 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.998 -0.62 . . . . 2.8799999999999999 112.137 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 33.3 mtt -77.39 137.23 38.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.36 . . . . 2.7000000000000002 110.778 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -122.79 174.13 7.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.11 -0.496 . . . . 3.4399999999999999 110.465 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -63.98 129.03 38.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 2.3399999999999999 110.898 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 58.26 49.36 11.26 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.295 0.569 . . . . 2.6299999999999999 110.879 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -79.31 178.58 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.652 -0.703 . . . . 2.2799999999999998 110.232 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.3 t -117.74 131.79 69.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.834 0.35 . . . . 2.6699999999999999 111.181 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 17.0 tt -134.81 132.5 53.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.288 -0.634 . . . . 2.0800000000000001 109.288 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -98.42 151.69 20.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.77 0.319 . . . . 2.8999999999999999 111.466 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -131.32 127.02 59.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.045 -0.525 . . . . 2.3599999999999999 110.353 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.05 160.54 35.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.949 -0.569 . . . . 3.0 109.823 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -85.65 145.55 27.26 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.874 0.368 . . . . 3.8100000000000001 110.945 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.44 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.2 mm-40 -84.62 133.27 34.42 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.179 -0.464 . . . . 3.6099999999999999 110.91 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -64.6 -28.47 69.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.859 -0.61 . . . . 5.0499999999999998 110.353 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -15.87 63.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 4.6799999999999997 111.458 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.07 -55.04 3.28 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.004 -0.617 . . . . 3.7999999999999998 112.104 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.627 -1.096 . . . . 3.6800000000000002 111.518 179.903 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.521 ' CG1' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 109.879 -0.415 . . . . 2.73 109.879 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.575 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 23.4 mt -69.93 122.0 20.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 109.073 -0.714 . . . . 2.1699999999999999 109.073 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -70.26 106.71 3.43 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.688 -0.687 . . . . 2.5299999999999998 111.836 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 8.4 mt . . . . . 0 C--N 1.319 -0.733 0 N-CA-C 109.502 -0.555 . . . . 2.3199999999999998 109.502 177.711 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.421 ' O ' HG21 ' A' ' 38' ' ' VAL . 45.1 mm . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.913 0.387 . . . . 2.2400000000000002 110.901 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -110.23 126.81 54.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.872 0.368 . . . . 3.7000000000000002 110.62 179.124 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 71.9 mt -104.38 132.77 50.26 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.242 -0.651 . . . . 1.77 109.242 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 86' ' ' ASP . 1.7 ptpm? -99.5 113.42 25.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 3.1299999999999999 110.598 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.646 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.2 t -83.41 121.1 35.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.064 -0.971 . . . . 1.76 110.003 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 32' ' ' SER . 43.2 mm -105.78 124.76 61.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.254 -0.43 . . . . 2.6000000000000001 110.946 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.4 178.82 35.76 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.826 -0.624 . . . . 2.6400000000000001 112.187 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -70.01 -31.03 68.49 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 3.73 111.03 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -87.61 24.46 1.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.937 0.399 . . . . 3.2400000000000002 111.085 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.5 m 62.01 37.96 14.51 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.636 -0.711 . . . . 3.29 111.649 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 1.2 p -91.07 145.96 24.25 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.212 -0.449 . . . . 2.5 110.363 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -127.76 118.8 24.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.978 0.418 . . . . 3.0099999999999998 110.315 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.2 mt -120.27 130.57 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 2.3199999999999998 109.482 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.659 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 14.6 m170 -88.21 148.53 24.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.508 . . . . 2.3999999999999999 110.987 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.49 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -133.65 113.09 11.99 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.135 -0.484 . . . . 1.9399999999999999 110.852 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -81.36 101.42 9.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 3.0099999999999998 110.431 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.421 HG21 ' O ' ' A' ' 22' ' ' ILE . 5.3 m -108.06 156.88 8.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.361 . . . . 2.0800000000000001 110.718 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -113.83 129.66 56.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.193 -0.458 . . . . 3.6299999999999999 109.89 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.431 ' C ' ' HG1' ' A' ' 41' ' ' THR . 55.7 ttp -71.44 85.53 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.287 0.565 . . . . 3.4100000000000001 110.263 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.431 ' HG1' ' C ' ' A' ' 40' ' ' MET . 21.8 m -165.04 -59.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.33 -0.85 . . . . 2.5099999999999998 109.082 179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 149.45 29.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.346 -0.843 . . . . 2.0 111.134 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.71 -178.92 2.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.154 -0.475 . . . . 2.96 110.37 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mt -78.34 -3.37 42.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.438 -0.346 . . . . 2.3799999999999999 111.27 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -61.73 -53.24 58.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.991 0.424 . . . . 2.7599999999999998 110.179 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -65.43 -36.16 83.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.874 -0.603 . . . . 2.54 110.721 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.62 -43.34 99.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.916 -0.583 . . . . 2.9900000000000002 111.274 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -66.64 -50.34 63.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.209 0.448 . . . . 2.3900000000000001 112.209 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -64.55 -43.53 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.68 0.622 . . . . 1.8799999999999999 112.68 -178.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 m -64.62 -33.07 75.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.61 0.243 . . . . 1.72 111.361 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -68.6 -42.46 78.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.907 -0.405 . . . . 1.8899999999999999 109.907 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.34 -35.33 78.76 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 1.99 110.809 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.4 -35.85 82.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 2.1699999999999999 110.453 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -72.17 -34.54 68.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 2.4900000000000002 110.76 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -81.31 -13.62 58.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 2.4100000000000001 110.497 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.09 39.67 44.64 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.163 -0.542 . . . . 2.7400000000000002 112.63 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.6 m -137.5 156.0 75.14 Favored Pre-proline 0 C--N 1.328 -0.351 0 N-CA-C 110.408 -0.219 . . . . 2.9399999999999999 110.408 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.31 146.8 90.61 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.666 2.244 . . . . 3.0899999999999999 112.645 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 5.2 ttt -78.5 55.29 1.59 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.892 -0.594 . . . . 2.5899999999999999 111.097 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -156.87 -16.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.112 -0.494 . . . . 3.7599999999999998 111.167 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.7 p -96.62 -8.61 31.25 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.119 -0.232 . . . . 3.0800000000000001 111.256 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 23.0 mt -115.35 126.74 54.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.9 0.381 . . . . 2.77 110.633 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.1 ptt-85 -115.06 128.67 56.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 3.5800000000000001 110.019 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -96.14 132.78 41.19 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.785 -0.643 . . . . 2.3999999999999999 109.65 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.5 mt -118.29 142.58 47.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.027 0.442 . . . . 3.6400000000000001 111.319 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -135.43 107.06 6.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.278 -0.874 . . . . 2.9700000000000002 109.034 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 61.09 34.04 19.26 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.052 0.454 . . . . 3.6400000000000001 111.175 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.57 -19.76 42.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.018 -0.611 . . . . 3.7999999999999998 112.759 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -89.9 133.86 34.53 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.15 -0.315 . . . . 5.0899999999999999 110.15 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.1 ptm85 -77.76 138.4 38.99 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.299 -0.56 . . . . 3.71 110.324 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.3 mm -79.27 111.35 16.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.648 -0.706 . . . . 2.5499999999999998 111.267 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.29 162.77 22.17 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 3.3799999999999999 109.832 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.88 -30.85 71.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.862 -0.608 . . . . 2.5899999999999999 111.476 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -82.84 4.22 26.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 3.4500000000000002 112.031 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -81.05 164.96 22.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.826 0.346 . . . . 3.6200000000000001 110.841 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 8.9 t -155.77 146.21 16.03 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.438 -0.579 . . . . 2.9900000000000002 109.438 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.56 -17.07 16.0 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.953 2.435 . . . . 2.21 112.927 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -73.32 -15.83 61.38 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.228 -0.442 . . . . 3.3500000000000001 110.787 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 12.5 pt-20 -119.38 171.4 8.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 3.1800000000000002 109.496 178.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 92.2 mt 73.13 -3.23 2.5 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.668 0.605 . . . . 3.2999999999999998 111.153 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.81 47.3 40.58 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 121.033 -0.604 . . . . 2.8799999999999999 113.053 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 10.1 mtt -73.2 131.57 42.16 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.858 -0.423 . . . . 2.7000000000000002 109.858 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 46.1 mt-10 -119.93 178.7 4.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.068 0.461 . . . . 3.4399999999999999 111.606 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -67.92 138.83 56.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.483 -0.78 . . . . 2.3399999999999999 110.535 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 57.59 39.05 27.98 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.593 0.558 . . . . 2.6299999999999999 110.641 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.51 ' O ' ' HG2' ' A' ' 25' ' ' LYS . 1.0 OUTLIER -77.47 164.76 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.015 -0.538 . . . . 2.2799999999999998 110.39 -179.803 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.0 t -103.19 132.86 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.144 0.497 . . . . 2.6699999999999999 111.877 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.646 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -132.98 127.82 55.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.691 -0.855 . . . . 2.0800000000000001 108.691 178.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -103.89 142.14 34.92 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.69 0.281 . . . . 2.8999999999999999 111.036 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.9 p -121.43 126.96 75.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.162 0.506 . . . . 2.3599999999999999 110.206 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -130.72 165.46 22.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.896 -0.593 . . . . 3.0 109.693 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -96.24 139.05 32.95 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.943 0.402 . . . . 3.8100000000000001 110.906 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.92 146.5 39.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.873 -0.603 . . . . 3.6099999999999999 109.584 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -69.42 -25.7 64.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.433 -0.349 . . . . 5.0499999999999998 111.303 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.93 -18.51 62.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.232 -0.44 . . . . 4.6799999999999997 111.437 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.88 -1.27 79.77 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.809 -0.71 . . . . 3.7999999999999998 112.593 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.944 -0.92 . . . . 3.6800000000000002 111.337 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.659 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 12.2 p . . . . . 0 N--CA 1.442 -0.826 0 CA-C-O 122.062 0.934 . . . . 2.73 110.624 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.434 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 6.4 mt -77.81 117.2 22.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 114.607 -1.179 . . . . 2.1699999999999999 109.859 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.29 106.31 8.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.805 0.336 . . . . 2.5299999999999998 110.909 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.314 -0.96 0 CA-C-O 121.521 0.676 . . . . 2.3199999999999998 109.346 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mm . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.547 0.213 . . . . 2.2400000000000002 111.204 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.42 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -121.28 119.27 31.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.343 -0.389 . . . . 3.7000000000000002 110.046 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 87.1 mt -103.51 144.59 31.21 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.221 -0.445 . . . . 1.77 110.0 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 mttp -99.81 103.08 14.68 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.313 -0.403 . . . . 3.1299999999999999 110.625 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 11.0 t -88.03 124.94 41.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.922 -0.581 . . . . 1.76 109.534 179.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 32' ' ' SER . 10.8 mm -119.37 137.41 53.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.014 0.435 . . . . 2.6000000000000001 111.533 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -112.18 172.76 14.96 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.923 -0.58 . . . . 2.6400000000000001 111.969 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 31.6 tp60 -65.52 -20.36 66.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.166 0.507 . . . . 3.73 111.325 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -89.31 18.42 5.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.389 -0.369 . . . . 3.2400000000000002 110.678 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.4 m 59.36 39.93 21.64 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.67 -0.696 . . . . 3.29 111.239 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.45 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 2.0 p -91.01 142.86 27.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.766 -0.652 . . . . 2.5 110.174 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -121.97 114.69 21.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.06 0.457 . . . . 3.0099999999999998 110.063 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.4 mm -126.03 133.55 68.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.979 -0.555 . . . . 2.3199999999999998 110.473 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.532 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 0.2 OUTLIER -91.99 150.2 21.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.061 0.458 . . . . 2.3999999999999999 110.219 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.521 ' CE1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -131.11 108.58 9.85 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.315 -0.402 . . . . 1.9399999999999999 111.832 -178.873 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -81.58 101.51 10.04 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.749 -0.463 . . . . 3.0099999999999998 109.749 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 17.1 m -115.85 166.94 9.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.175 0.512 . . . . 2.0800000000000001 112.287 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -115.04 136.51 53.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.322 -0.854 . . . . 3.6299999999999999 108.987 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 43.4 ttp -78.3 85.31 4.44 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.754 0.311 . . . . 3.4100000000000001 110.495 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.45 -44.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.605 -0.725 . . . . 2.5099999999999998 109.853 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 148.17 36.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.683 -0.69 . . . . 2.0 111.266 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -67.17 167.85 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 2.96 110.362 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 78.7 mt -75.29 -3.81 35.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 2.3799999999999999 111.08 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.88 -47.2 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.261 -0.644 . . . . 2.7599999999999998 109.261 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -57.09 -40.1 76.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.272 -0.876 . . . . 2.54 110.73 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -57.03 -39.2 74.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.587 -0.733 . . . . 2.9900000000000002 110.895 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -79.0 -55.33 5.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.8 -0.636 . . . . 2.3900000000000001 112.518 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -44.48 94.91 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.017 0.747 . . . . 1.8799999999999999 113.017 -177.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 63.3 m -62.91 -35.33 79.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.624 0.193 . . . . 1.72 111.229 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -66.9 -45.35 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.577 -0.527 . . . . 1.8899999999999999 109.577 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 59.5 m -62.17 -37.36 84.96 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.823 -0.626 . . . . 1.99 110.342 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -61.32 -44.45 97.18 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.975 -0.557 . . . . 2.1699999999999999 111.13 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.417 ' CZ ' HG12 ' B' ' 5' ' ' ILE . 10.4 ttp180 -76.41 -24.49 54.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.846 0.355 . . . . 2.4900000000000002 110.837 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -75.48 -33.79 60.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.361 -0.382 . . . . 2.4100000000000001 110.266 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.44 32.34 6.7 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.766 -0.652 . . . . 2.7400000000000002 111.851 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.21 152.26 79.83 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 122.928 -0.16 . . . . 2.9399999999999999 110.595 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.47 154.39 74.51 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.646 2.231 . . . . 3.0899999999999999 112.129 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.493 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 11.3 tpt -66.59 145.53 55.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.256 -0.429 . . . . 2.5899999999999999 110.572 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.3 m120 76.54 10.18 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.523 0.729 . . . . 3.7599999999999998 112.344 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.7 p -90.38 -17.71 26.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.297 -0.631 . . . . 3.0800000000000001 109.297 178.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 72.6 mt -124.15 149.13 46.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.362 -0.835 . . . . 2.77 110.092 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.524 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 32.5 ptt-85 -119.2 128.61 54.38 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.042 0.449 . . . . 3.5800000000000001 109.886 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -95.81 132.71 40.77 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.946 -0.57 . . . . 2.3999999999999999 109.841 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.8 mt -112.47 138.59 49.01 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.212 0.529 . . . . 3.6400000000000001 111.307 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -138.41 110.12 7.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 2.9700000000000002 108.51 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 64.52 31.92 12.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.939 -0.573 . . . . 3.6400000000000001 110.873 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.53 -31.53 6.72 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.858 -0.686 . . . . 3.7999999999999998 113.173 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -87.62 161.41 17.71 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.435 -0.209 . . . . 5.0899999999999999 110.435 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -94.04 143.66 26.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.968 0.413 . . . . 3.71 110.584 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 30.4 mm -78.46 121.57 31.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.858 -0.61 . . . . 2.5499999999999998 111.81 -179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -88.74 157.19 18.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 3.3799999999999999 109.891 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -68.9 -22.28 64.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.385 -0.37 . . . . 2.5899999999999999 111.884 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -95.17 8.68 42.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.682 0.277 . . . . 3.4500000000000002 111.625 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -90.79 153.42 20.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.777 0.322 . . . . 3.6200000000000001 110.403 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.6 p -123.18 161.38 45.31 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.236 -0.438 . . . . 2.9900000000000002 111.307 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -68.54 -17.89 43.32 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.685 2.257 . . . . 2.21 111.845 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.1 -42.49 66.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.895 -0.593 . . . . 3.3500000000000001 110.546 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.413 ' HG3' ' HG ' ' A' ' 80' ' ' LEU . 15.1 pt-20 -84.09 176.01 9.1 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.102 -0.499 . . . . 3.1800000000000002 110.243 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.413 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 33.1 mt 73.38 -42.56 0.53 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.502 0.721 . . . . 3.2999999999999998 111.88 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.41 54.29 0.66 Allowed Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.648 -0.581 . . . . 2.8799999999999999 111.648 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.7 ttm -90.47 115.58 27.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.955 0.407 . . . . 2.7000000000000002 110.15 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 34.5 mt-10 -103.53 -178.74 3.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.065 -0.516 . . . . 3.4399999999999999 111.375 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.497 ' HG3' ' HG2' ' A' ' 85' ' ' GLU . 10.1 tp10 -73.4 142.81 46.96 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.109 -0.7 . . . . 2.3399999999999999 109.109 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.497 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 81.2 mm-40 60.32 41.27 16.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.194 0.521 . . . . 2.6299999999999999 109.923 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.4 t0 -85.55 172.46 10.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 2.2799999999999998 110.973 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.4 t -117.92 138.72 47.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.04 0.447 . . . . 2.6699999999999999 111.668 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 10.4 tt -142.54 127.92 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.536 -0.756 . . . . 2.0800000000000001 109.035 178.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -97.95 160.0 14.58 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.896 0.379 . . . . 2.8999999999999999 111.452 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 p -138.1 127.57 33.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.935 -0.575 . . . . 2.3599999999999999 109.916 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -132.85 153.21 51.54 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.455 -0.339 . . . . 3.0 110.392 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -78.48 134.57 37.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.281 -0.418 . . . . 3.8100000000000001 110.91 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.524 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.9 mm-40 -78.01 143.19 37.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.182 -0.463 . . . . 3.6099999999999999 110.026 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -62.35 -23.75 66.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.95 -0.568 . . . . 5.0499999999999998 111.001 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.4 p -71.84 -30.37 65.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.782 -0.645 . . . . 4.6799999999999997 110.763 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.91 15.07 81.66 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.761 -0.654 . . . . 3.7999999999999998 112.233 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.88 0 CA-C-O 119.161 -0.799 . . . . 3.6800000000000002 111.346 -179.858 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 1.9 t . . . . . 0 N--CA 1.446 -0.628 0 CA-C-O 120.9 0.381 . . . . 2.73 111.163 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' ILE . . . . . 0.521 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 16.2 mt -70.91 128.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.077 -0.712 . . . . 2.1699999999999999 109.077 178.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -80.6 105.85 12.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.832 0.348 . . . . 2.5299999999999998 111.147 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.434 HD21 ' CE1' ' A' ' 36' ' ' PHE . 1.3 tp . . . . . 0 C--N 1.316 -0.875 0 N-CA-C 108.452 -0.944 . . . . 2.3199999999999998 108.452 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 110.161 -0.311 . . . . 3.1299999999999999 110.161 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm -90.38 135.0 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 110.205 -0.294 . . . . 2.2400000000000002 110.205 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.0 ttpm? -113.72 120.22 40.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.29 0.567 . . . . 3.7000000000000002 111.538 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.5 mt -104.18 150.24 24.55 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.139 -0.689 . . . . 1.77 109.139 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -103.93 121.39 43.03 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.92 -0.312 . . . . 3.1299999999999999 110.878 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.6 t -93.08 121.39 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.904 -0.589 . . . . 1.76 109.988 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.4 mm -103.37 120.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.907 0.384 . . . . 2.6000000000000001 111.017 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.58 167.87 24.83 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.653 -0.703 . . . . 2.6400000000000001 111.583 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -77.01 -17.71 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.116 0.484 . . . . 3.73 110.639 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -85.88 20.96 2.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.465 . . . . 3.2400000000000002 110.364 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 58.96 64.3 1.44 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.596 -0.729 . . . . 3.29 110.91 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -135.76 144.58 45.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.491 -0.777 . . . . 2.5 110.462 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -126.04 94.3 4.06 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.443 -0.577 . . . . 3.0099999999999998 109.443 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.8 mm -90.5 145.4 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.056 -0.52 . . . . 2.3199999999999998 110.9 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.506 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 32.6 m170 -89.02 132.98 34.5 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.888 -0.782 . . . . 2.3999999999999999 108.888 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -123.16 110.52 15.37 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.817 0.341 . . . . 1.9399999999999999 110.884 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.403 ' HB2' HG21 ' B' ' 4' ' ' VAL . 24.3 ttmt -81.48 110.65 17.08 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.949 -0.569 . . . . 3.0099999999999998 110.712 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.7 m -114.13 154.69 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.088 0.47 . . . . 2.0800000000000001 110.465 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HG2' HG22 ' A' ' 41' ' ' THR . 52.6 tttt -106.67 127.27 53.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.378 -0.374 . . . . 3.6299999999999999 110.143 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.621 ' O ' ' HB ' ' A' ' 41' ' ' THR . 63.1 tpp -74.3 85.88 1.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 3.4100000000000001 110.565 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.621 ' HB ' ' O ' ' A' ' 40' ' ' MET . 7.4 t 154.31 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.274 1.03 . . . . 2.5099999999999998 109.055 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.6 m -84.33 134.89 34.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.867 -0.606 . . . . 2.0 110.573 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.15 132.95 54.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.929 -0.578 . . . . 2.96 110.104 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.93 -18.45 60.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 2.3799999999999999 110.833 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 34.0 tptt -53.9 -47.41 71.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.265 0.555 . . . . 2.7599999999999998 109.764 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.9 -43.35 83.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.257 -0.883 . . . . 2.54 111.063 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -44.76 96.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.836 0.351 . . . . 2.9900000000000002 111.077 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -61.25 -52.82 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.041 -0.527 . . . . 2.3900000000000001 112.354 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.7 pt-20 -63.32 -44.12 95.86 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.422 0.527 . . . . 1.8799999999999999 112.422 -178.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.435 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 3.9 m -65.55 -33.44 75.93 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.275 -0.17 . . . . 1.72 111.347 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -69.31 -37.28 77.7 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.574 -0.45 . . . . 1.8899999999999999 110.012 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 66.7 m -60.95 -39.7 90.48 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.256 -0.646 . . . . 1.99 109.256 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.435 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 85.1 mt-30 -63.79 -39.65 94.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.283 -0.872 . . . . 2.1699999999999999 110.156 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -64.84 -33.62 76.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.055 0.455 . . . . 2.4900000000000002 109.788 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -70.87 -35.59 72.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.862 -0.608 . . . . 2.4100000000000001 110.03 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.65 20.63 8.81 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.01 -0.614 . . . . 2.7400000000000002 112.088 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.7 m -132.62 155.83 80.78 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.438 -0.208 . . . . 2.9399999999999999 110.438 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.51 164.03 36.75 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.239 1.959 . . . . 3.0899999999999999 111.217 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 12.3 ttt -71.27 163.04 28.42 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 121.172 -0.211 . . . . 2.5899999999999999 110.564 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 59' ' ' MET . 16.2 m120 75.7 -0.85 3.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.301 0.64 . . . . 3.7599999999999998 111.843 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.6 p -85.26 -29.96 24.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.19 0.519 . . . . 3.0800000000000001 109.809 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.6 mt -119.59 146.13 45.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.472 -0.786 . . . . 2.77 110.594 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -110.8 134.04 52.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.982 -0.554 . . . . 3.5800000000000001 110.023 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -96.44 120.53 36.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 2.3999999999999999 109.315 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.5 mt -108.19 130.57 55.13 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.284 0.564 . . . . 3.6400000000000001 111.572 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -127.46 108.2 10.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.076 -0.965 . . . . 2.9700000000000002 108.409 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.94 17.46 10.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 3.6400000000000001 111.013 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.77 -26.65 20.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.085 -0.579 . . . . 3.7999999999999998 112.285 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -87.03 145.9 26.31 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.87 -0.419 . . . . 5.0899999999999999 109.87 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -81.42 133.71 35.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.219 0.533 . . . . 3.71 110.383 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 24.0 mm -74.2 113.89 13.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.818 -0.628 . . . . 2.5499999999999998 110.318 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.414 ' HB1' ' CD2' ' A' ' 75' ' ' HIS . . . -72.38 155.72 39.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.809 -0.632 . . . . 3.3799999999999999 110.497 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -65.23 -34.73 79.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.364 0.602 . . . . 2.5899999999999999 110.434 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -86.99 34.24 0.67 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.523 -0.762 . . . . 3.4500000000000002 111.977 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.414 ' CD2' ' HB1' ' A' ' 72' ' ' ALA . 17.2 m170 -114.91 159.34 20.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.11 0.481 . . . . 3.6200000000000001 111.086 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.479 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 3.0 p -133.83 157.69 77.21 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.657 -0.702 . . . . 2.9900000000000002 109.761 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -64.28 -14.29 43.04 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.412 2.075 . . . . 2.21 112.762 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -68.37 -36.35 79.06 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.217 -0.447 . . . . 3.3500000000000001 110.673 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.07 177.65 5.91 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.422 -0.584 . . . . 3.1800000000000002 109.422 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.6 mt 73.62 -47.29 0.65 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 123.652 0.595 . . . . 3.2999999999999998 110.825 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.71 47.06 0.75 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.091 -0.576 . . . . 2.8799999999999999 111.858 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.6 mtt -77.85 132.98 38.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.945 0.402 . . . . 2.7000000000000002 110.62 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 32.3 mt-10 -126.2 177.04 6.64 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.121 -0.491 . . . . 3.4399999999999999 110.788 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.407 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.7 tp10 -71.87 143.13 49.51 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.088 -0.708 . . . . 2.3399999999999999 109.088 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 66.64 28.42 9.19 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.504 0.503 . . . . 2.6299999999999999 110.577 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.2 t0 -74.59 168.92 18.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.032 -0.531 . . . . 2.2799999999999998 110.403 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.5 t -120.19 124.62 73.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.754 0.311 . . . . 2.6699999999999999 111.245 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -125.31 133.05 70.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.572 -0.529 . . . . 2.0800000000000001 109.572 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.11 150.57 23.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.914 0.388 . . . . 2.8999999999999999 111.217 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -133.96 128.12 52.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.002 -0.545 . . . . 2.3599999999999999 110.521 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -132.96 162.25 32.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.262 -0.426 . . . . 3.0 110.09 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -89.97 134.88 33.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.021 0.439 . . . . 3.8100000000000001 110.981 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -72.39 150.26 43.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 3.6099999999999999 109.624 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -63.14 -35.97 82.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.388 -0.369 . . . . 5.0499999999999998 111.509 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 p -68.13 -31.63 71.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.859 0.361 . . . . 4.6799999999999997 111.212 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.57 -10.05 68.92 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.017 -0.611 . . . . 3.7999999999999998 111.941 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.707 -1.052 . . . . 3.6800000000000002 111.974 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 56.1 mmtt . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.01 -0.367 . . . . 8.0399999999999991 110.01 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.1 t -77.39 148.6 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.493 -0.558 . . . . 3.1899999999999999 109.493 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -68.41 138.19 55.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.812 0.339 . . . . 2.5 110.654 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 12.1 p -97.3 124.35 50.14 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 N-CA-C 108.603 -0.888 . . . . 2.73 108.603 179.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.454 HG22 ' HG ' ' B' ' 7' ' ' LEU . 3.9 mt -68.86 104.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.701 -0.682 . . . . 2.1699999999999999 110.33 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -83.16 104.6 13.47 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.836 -0.62 . . . . 2.5299999999999998 110.486 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.454 ' HG ' HG22 ' B' ' 5' ' ' ILE . 96.7 mt -135.09 12.7 3.59 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.238 0.542 . . . . 2.3199999999999998 109.678 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 17.4 p -72.65 133.35 44.6 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.632 -0.713 . . . . 3.3500000000000001 110.77 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 38.8 mt -67.55 94.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.294 0.568 . . . . 4.3600000000000003 110.371 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -156.24 -63.5 0.11 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.941 -1.027 . . . . 6.2199999999999998 108.449 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 1.4 m -100.55 141.47 33.36 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.369 -0.832 . . . . 5.8200000000000003 109.132 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 10.1 m -74.19 87.27 1.93 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.965 0.412 . . . . 6.3700000000000001 110.582 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.2 m -130.72 17.68 5.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.317 0.488 . . . . 5.9000000000000004 112.317 -178.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 19.7 t0 . . . . . 0 C--N 1.327 -0.404 0 C-N-CA 120.747 -0.381 . . . . 5.6200000000000001 110.304 179.296 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.709 ' CD2' HG21 ' B' ' 8' ' ' THR . 20.1 m-85 . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 109.51 -0.552 . . . . 3.1299999999999999 109.51 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.9 mm -73.35 119.4 20.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.787 0.327 . . . . 2.2400000000000002 110.736 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.638 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -97.69 123.37 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 3.7000000000000002 110.678 179.201 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' A' ' 36' ' ' PHE . 70.8 mt -110.58 118.2 35.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.871 -0.604 . . . . 1.77 109.517 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -80.83 109.32 15.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.905 0.383 . . . . 3.1299999999999999 110.631 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.1 t -81.02 115.46 23.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.734 -0.666 . . . . 1.76 109.999 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.5 mm -107.3 126.97 63.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.031 -0.531 . . . . 2.6000000000000001 110.707 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.57 172.32 21.9 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.797 -0.716 . . . . 2.6400000000000001 111.855 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -64.72 -23.07 67.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.163 0.506 . . . . 3.73 111.113 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.71 15.87 5.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.214 -0.448 . . . . 3.2400000000000002 110.634 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.5 m 61.92 37.01 15.48 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.958 -0.565 . . . . 3.29 111.036 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -86.39 152.14 22.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.856 -0.611 . . . . 2.5 110.798 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -125.99 115.64 20.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.266 -0.424 . . . . 3.0099999999999998 110.323 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -125.97 139.38 51.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.51 -0.552 . . . . 2.3199999999999998 109.51 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.463 ' HB3' HG13 ' B' ' 4' ' ' VAL . 10.5 m170 -88.54 158.44 18.3 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.184 0.516 . . . . 2.3999999999999999 111.176 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.638 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.05 120.12 12.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.279 -0.419 . . . . 1.9399999999999999 110.765 -179.365 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.405 ' CB ' HG11 ' B' ' 4' ' ' VAL . 5.2 mtmt -100.02 96.87 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.664 0.268 . . . . 3.0099999999999998 110.376 179.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 m -113.8 162.66 11.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.896 0.379 . . . . 2.0800000000000001 110.945 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.5 tttt -128.28 141.43 51.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.189 -0.46 . . . . 3.6299999999999999 109.899 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.43 ' C ' ' HG1' ' A' ' 41' ' ' THR . 30.6 ttm -78.09 84.99 4.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.303 0.573 . . . . 3.4100000000000001 110.331 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.43 ' HG1' ' C ' ' A' ' 40' ' ' MET . 16.2 m -163.74 -46.32 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.327 -0.852 . . . . 2.5099999999999998 109.115 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.69 149.07 22.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.296 -0.865 . . . . 2.0 111.507 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -63.93 152.59 39.5 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.27 -0.423 . . . . 2.96 110.42 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.7 mt -67.82 -11.86 59.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.766 0.317 . . . . 2.3799999999999999 111.177 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.446 ' HG3' ' N ' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -65.85 -30.71 71.37 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.343 -0.614 . . . . 2.7599999999999998 109.343 178.64 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.446 ' N ' ' HG3' ' A' ' 45' ' ' LYS . 42.4 tptt -68.88 -32.73 72.6 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.5 -0.773 . . . . 2.54 109.074 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.476 ' HA ' ' CD1' ' B' ' 7' ' ' LEU . 0.5 OUTLIER -68.81 -41.69 78.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.195 -0.911 . . . . 2.9900000000000002 110.043 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -64.5 -51.78 61.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.464 -0.789 . . . . 2.3900000000000001 111.834 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.6 pt-20 -66.29 -43.64 85.75 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.302 0.482 . . . . 1.8799999999999999 112.302 -178.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.429 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 50.3 m -61.46 -36.58 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 122.4 -0.187 . . . . 1.72 111.384 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -68.88 -38.54 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.822 -0.436 . . . . 1.8899999999999999 109.822 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 75.4 m -63.13 -42.27 99.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 1.99 109.698 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.429 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.7 mt-30 -64.99 -35.62 81.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.853 -0.612 . . . . 2.1699999999999999 110.2 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.08 -42.45 80.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.744 -0.662 . . . . 2.4900000000000002 110.778 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -79.23 -11.81 59.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 2.4100000000000001 111.332 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.5 31.67 44.93 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.014 -0.612 . . . . 2.7400000000000002 112.632 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.9 m -121.78 156.53 58.93 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 122.892 -0.181 . . . . 2.9399999999999999 110.731 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -69.54 159.99 51.45 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.642 2.228 . . . . 3.0899999999999999 112.103 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.8 145.58 53.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.234 -0.439 . . . . 2.5899999999999999 111.16 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 71.64 16.81 5.7 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.702 0.801 . . . . 3.7599999999999998 112.541 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.2 p -92.42 -27.6 17.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.461 0.648 . . . . 3.0800000000000001 109.611 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.3 mt -111.66 141.75 44.86 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.21 -0.904 . . . . 2.77 110.245 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.453 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 11.4 ptt180 -107.92 118.95 38.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.546 -0.539 . . . . 3.5800000000000001 109.546 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.04 124.81 35.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.619 -0.719 . . . . 2.3999999999999999 109.748 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.7 mt -114.34 136.7 52.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.335 0.588 . . . . 3.6400000000000001 112.052 -178.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -129.94 107.47 9.39 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.741 -1.118 . . . . 2.9700000000000002 108.521 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 61.27 35.23 18.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.979 -0.555 . . . . 3.6400000000000001 110.982 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.3 -5.42 84.42 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.865 -0.607 . . . . 3.7999999999999998 113.202 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -104.48 148.0 26.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.152 -0.314 . . . . 5.0899999999999999 110.152 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 70' ' ' ARG . 12.4 ptm180 -85.94 139.47 31.18 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.43 -0.508 . . . . 3.71 110.476 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 37.4 mm -75.27 113.82 14.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.839 -0.619 . . . . 2.5499999999999998 111.403 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.13 161.42 22.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.161 -0.472 . . . . 3.3799999999999999 110.047 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.5 -23.82 58.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.252 -0.431 . . . . 2.5899999999999999 110.971 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -90.56 3.17 54.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.307 -0.406 . . . . 3.4500000000000002 110.82 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -85.14 147.08 26.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 3.6200000000000001 110.512 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 40.1 p -126.11 160.93 54.69 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.077 -0.511 . . . . 2.9900000000000002 110.14 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.37 -7.92 21.54 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.503 2.135 . . . . 2.21 112.023 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -76.23 -31.34 58.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.829 -0.623 . . . . 3.3500000000000001 110.365 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.4 pt-20 -102.33 -171.01 1.89 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 3.1800000000000002 110.355 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 62.2 mt 72.72 -36.24 0.35 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.523 0.729 . . . . 3.2999999999999998 111.924 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 104.65 35.02 3.38 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.944 -0.646 . . . . 2.8799999999999999 111.856 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.1 mtt -70.12 129.1 38.5 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.913 0.387 . . . . 2.7000000000000002 111.091 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -126.76 176.27 7.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.054 -0.521 . . . . 3.4399999999999999 110.17 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -64.23 142.71 58.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.182 -0.463 . . . . 2.3399999999999999 110.398 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 54.66 50.68 15.36 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.672 0.608 . . . . 2.6299999999999999 111.221 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.68 -175.61 4.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.418 -0.356 . . . . 2.2799999999999998 110.366 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.95 138.67 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 2.6699999999999999 111.407 -178.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.477 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 14.9 tt -137.11 132.27 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.146 -0.687 . . . . 2.0800000000000001 109.146 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -104.36 146.21 29.15 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.596 0.236 . . . . 2.8999999999999999 110.663 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p -131.47 129.95 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.046 0.45 . . . . 2.3599999999999999 110.431 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -134.68 162.79 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.035 -0.53 . . . . 3.0 110.135 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -83.9 135.6 34.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.602 -0.272 . . . . 3.8100000000000001 110.852 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.453 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 7.1 mm-40 -77.19 146.91 36.75 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.113 -0.328 . . . . 3.6099999999999999 110.113 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -68.13 -26.0 65.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.868 0.366 . . . . 5.0499999999999998 110.792 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -35.19 79.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.15 -0.477 . . . . 4.6799999999999997 111.125 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.11 -37.65 3.37 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.886 -0.673 . . . . 3.7999999999999998 112.203 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.909 0 CA-C-O 118.7 -1.056 . . . . 3.6800000000000002 111.762 179.904 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 72.1 mttt . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 110.102 -0.333 . . . . 8.0399999999999991 110.102 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.9 t -117.4 105.89 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 N-CA-C 109.507 -0.553 . . . . 3.1899999999999999 109.507 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -119.15 143.42 47.22 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.179 -0.674 . . . . 2.5 109.179 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.463 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.2 OUTLIER -94.99 106.6 18.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.664 0.268 . . . . 2.73 110.853 -178.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.407 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 13.7 mt -69.72 115.98 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.479 -0.563 . . . . 2.1699999999999999 109.479 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . 0.434 ' O ' HD23 ' B' ' 7' ' ' LEU . 20.4 m-20 -72.27 106.13 4.32 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 116.665 -0.243 . . . . 2.5299999999999998 110.948 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.476 ' CD1' ' HA ' ' A' ' 47' ' ' LEU . 11.2 mt -120.13 7.1 10.77 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.682 -0.488 . . . . 2.3199999999999998 109.682 178.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' THR . . . . . 0.709 HG21 ' CD2' ' A' ' 21' ' ' TYR . 56.9 p -64.94 102.41 0.6 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.804 -0.634 . . . . 3.3500000000000001 111.041 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 27.5 mt -129.54 126.51 63.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.794 -0.447 . . . . 4.3600000000000003 109.794 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -91.35 -39.33 12.09 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.853 -0.339 . . . . 6.2199999999999998 110.955 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.29 -57.3 0.49 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.613 -0.267 . . . . 5.8200000000000003 111.464 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 3.9 p -166.75 -86.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.977 0.418 . . . . 6.3700000000000001 111.446 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -94.48 50.59 1.36 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.974 -0.557 . . . . 5.9000000000000004 111.274 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 116.279 -0.419 . . . . 5.6200000000000001 109.989 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.464 ' CZ ' ' HB ' ' B' ' 8' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.033 -0.358 . . . . 3.1299999999999999 110.033 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.407 HG21 ' HA ' ' A' ' 84' ' ' GLU . 32.3 mm -73.26 122.1 25.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.869 -0.419 . . . . 2.2400000000000002 109.869 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.555 ' HE3' ' CD2' ' A' ' 35' ' ' HIS . 9.6 ttpt -98.62 119.34 37.18 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.352 -0.385 . . . . 3.7000000000000002 110.462 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 85.5 mt -101.58 142.18 33.34 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.929 -0.578 . . . . 1.77 110.012 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -97.69 103.08 14.99 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.798 -0.445 . . . . 3.1299999999999999 109.798 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.9 t -82.37 116.08 25.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.108 -0.497 . . . . 1.76 110.045 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.523 ' HA ' ' O ' ' A' ' 32' ' ' SER . 38.1 mm -108.16 123.25 63.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.928 -0.578 . . . . 2.6000000000000001 111.159 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.72 177.93 32.09 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.73 -0.748 . . . . 2.6400000000000001 111.591 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -69.0 -20.47 64.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.237 0.542 . . . . 3.73 110.471 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -86.18 11.7 11.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.58 -0.736 . . . . 3.2400000000000002 110.343 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.1 m 62.0 34.11 16.87 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.394 -0.821 . . . . 3.29 111.968 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.523 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 29.1 p -92.57 150.19 20.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.318 -0.623 . . . . 2.5 109.318 178.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.5 ' O ' HG13 ' B' ' 2' ' ' VAL . 2.0 mt-10 -124.36 112.77 17.35 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.977 -0.379 . . . . 3.0099999999999998 109.977 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 15.8 mm -111.96 142.78 23.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.791 -0.448 . . . . 2.3199999999999998 109.791 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.555 ' CD2' ' HE3' ' A' ' 23' ' ' LYS . 47.5 m170 -91.35 140.26 29.94 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.923 0.392 . . . . 2.3999999999999999 110.17 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.533 ' CE1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -131.67 121.69 24.7 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.332 0.493 . . . . 1.9399999999999999 112.332 -178.385 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.5 ' HE3' ' HB ' ' B' ' 4' ' ' VAL . 32.0 mttt -81.39 99.46 8.71 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.557 -0.292 . . . . 3.0099999999999998 110.474 177.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.7 p -115.53 163.7 12.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.983 0.42 . . . . 2.0800000000000001 111.06 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.32 144.06 46.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.419 -0.355 . . . . 3.6299999999999999 110.154 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.6 84.67 7.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.223 0.535 . . . . 3.4100000000000001 109.744 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -166.8 -60.31 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.653 -0.869 . . . . 2.5099999999999998 108.653 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.7 m -76.45 148.46 37.24 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.919 -1.037 . . . . 2.0 110.304 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -62.12 156.73 20.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.001 0.429 . . . . 2.96 111.145 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.09 -5.41 35.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.038 -0.528 . . . . 2.3799999999999999 110.588 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -61.9 -42.91 99.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.496 -0.774 . . . . 2.7599999999999998 109.182 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -61.94 -39.3 91.63 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.584 -0.735 . . . . 2.54 109.628 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -38.39 81.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.293 -0.867 . . . . 2.9900000000000002 110.184 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -73.05 -52.63 13.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.71 . . . . 2.3900000000000001 112.512 -178.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 10.0 pt-20 -67.66 -44.31 78.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.936 0.717 . . . . 1.8799999999999999 112.936 -177.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.0 m -59.16 -34.94 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.794 0.331 . . . . 1.72 111.172 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.401 ' HD1' ' CE2' ' A' ' 36' ' ' PHE . 27.9 t80 -66.38 -44.1 84.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.048 0.451 . . . . 1.8899999999999999 109.818 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 58.0 m -61.66 -33.92 74.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.425 -0.807 . . . . 1.99 110.79 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 97.5 mt-30 -63.31 -40.37 97.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 2.1699999999999999 110.975 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 -74.07 -33.53 63.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 2.4900000000000002 110.619 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -79.79 -8.34 59.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.993 0.425 . . . . 2.4100000000000001 110.77 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.79 36.06 66.23 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.998 -0.546 . . . . 2.7400000000000002 113.14 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 8.0 m -131.88 149.85 74.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 O-C-N 122.621 -0.34 . . . . 2.9399999999999999 110.698 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -65.84 156.57 63.51 Favored 'Trans proline' 0 N--CA 1.464 -0.206 0 C-N-CA 122.493 2.129 . . . . 3.0899999999999999 111.626 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.505 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 20.3 ttt -69.82 152.98 43.94 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 121.109 -0.236 . . . . 2.5899999999999999 110.426 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.9 m120 78.96 -0.19 2.39 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.618 0.767 . . . . 3.7599999999999998 112.076 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.3 p -83.68 -24.67 31.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.65 0.738 . . . . 3.0800000000000001 109.131 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -120.61 145.39 47.43 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.911 -1.04 . . . . 2.77 109.836 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.7 ptt-85 -112.33 138.82 48.5 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.043 -0.526 . . . . 3.5800000000000001 109.787 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.401 ' HA ' ' O ' ' A' ' 89' ' ' GLU . 49.2 m-85 -107.0 128.26 54.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.482 -0.562 . . . . 2.3999999999999999 109.482 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.7 mp -116.14 134.42 54.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.226 0.536 . . . . 3.6400000000000001 112.05 -178.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.402 ' HE1' ' OD1' ' A' ' 86' ' ' ASP . 65.2 t80 -129.63 115.56 17.56 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.354 -0.839 . . . . 2.9700000000000002 109.016 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.39 26.32 15.71 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.818 -0.628 . . . . 3.6400000000000001 111.391 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.64 -20.73 49.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.985 -0.626 . . . . 3.7999999999999998 113.426 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -99.79 138.68 36.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.955 0.377 . . . . 5.0899999999999999 110.631 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -75.46 135.85 40.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.331 0.586 . . . . 3.71 110.469 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 36.9 mm -71.05 126.44 31.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.327 -0.851 . . . . 2.5499999999999998 111.86 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -91.98 162.59 14.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.668 -0.696 . . . . 3.3799999999999999 109.729 178.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -72.92 -24.96 60.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.85 0.357 . . . . 2.5899999999999999 111.406 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -87.95 3.61 48.0 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.86 0.362 . . . . 3.4500000000000002 110.755 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.45 ' HD1' HD13 ' A' ' 80' ' ' LEU . 13.9 m170 -86.48 152.21 22.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.008 0.432 . . . . 3.6200000000000001 111.013 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.491 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 20.6 p -129.97 161.77 57.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.612 -0.722 . . . . 2.9900000000000002 109.8 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -69.13 -13.22 35.86 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.389 2.059 . . . . 2.21 111.765 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -74.0 -34.6 64.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.764 -0.653 . . . . 3.3500000000000001 110.418 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.3 pt-20 -91.84 175.88 6.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.43 -0.581 . . . . 3.1800000000000002 109.43 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.45 HD13 ' HD1' ' A' ' 75' ' ' HIS . 24.1 mt 72.04 -29.96 0.2 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.091 0.556 . . . . 3.2999999999999998 111.845 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.474 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 95.64 36.82 5.21 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.977 -0.63 . . . . 2.8799999999999999 112.181 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 50.2 mtp -73.68 131.24 41.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.765 -0.457 . . . . 2.7000000000000002 109.765 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -125.37 -169.06 1.93 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.741 0.305 . . . . 3.4399999999999999 111.32 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.407 ' HA ' HG21 ' A' ' 22' ' ' ILE . 9.9 tp10 -71.06 142.83 50.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.986 -0.552 . . . . 2.3399999999999999 110.606 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 59.8 32.25 21.23 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 123.548 0.53 . . . . 2.6299999999999999 111.223 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.402 ' OD1' ' HE1' ' A' ' 66' ' ' PHE . 1.1 t0 -76.53 171.01 15.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 2.2799999999999998 110.628 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.6 t -118.08 140.34 41.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.084 0.469 . . . . 2.6699999999999999 111.707 -178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.51 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.1 tt -139.0 127.64 28.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.149 -0.686 . . . . 2.0800000000000001 109.149 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.401 ' O ' ' HA ' ' A' ' 64' ' ' PHE . 44.5 mt-10 -94.8 149.29 21.4 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.651 0.263 . . . . 2.8999999999999999 111.564 -178.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -130.5 125.66 59.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.131 -0.486 . . . . 2.3599999999999999 110.241 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -132.56 161.54 33.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.308 -0.405 . . . . 3.0 110.515 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -86.92 130.93 34.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.806 0.336 . . . . 3.8100000000000001 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.73 140.16 42.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.488 -0.324 . . . . 3.6099999999999999 110.17 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -56.56 -36.28 69.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.945 -0.57 . . . . 5.0499999999999998 111.156 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.34 -29.54 70.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.114 -0.494 . . . . 4.6799999999999997 111.847 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.09 -1.04 86.43 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.06 -0.591 . . . . 3.7999999999999998 112.586 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.692 -1.06 . . . . 3.6800000000000002 111.833 179.89 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 46.3 mttm . . . . . 0 N--CA 1.48 1.029 0 CA-C-O 120.752 0.311 . . . . 8.0399999999999991 110.376 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.5 HG13 ' O ' ' A' ' 33' ' ' GLU . 3.3 t -117.87 148.11 20.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 109.722 -0.473 . . . . 3.1899999999999999 109.722 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -69.42 144.5 53.31 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.984 -0.376 . . . . 2.5 109.984 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.5 ' HB ' ' HE3' ' A' ' 37' ' ' LYS . 1.6 t -107.61 118.51 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 N-CA-C 109.759 -0.459 . . . . 2.73 109.759 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.533 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 21.4 mt -68.64 118.47 12.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.725 -0.472 . . . . 2.1699999999999999 109.725 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -76.51 121.34 22.99 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.871 -0.604 . . . . 2.5299999999999998 111.31 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mp -125.27 22.47 7.81 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.506 0.67 . . . . 2.3199999999999998 109.4 178.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' THR . . . . . 0.464 ' HB ' ' CZ ' ' A' ' 21' ' ' TYR . 4.3 t -87.2 -31.14 20.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.172 -0.922 . . . . 3.3500000000000001 111.735 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 23.3 mm -79.59 79.21 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.384 0.611 . . . . 4.3600000000000003 110.094 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -92.04 -29.58 16.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.471 -0.786 . . . . 6.2199999999999998 109.658 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -112.71 91.44 3.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.63 -0.713 . . . . 5.8200000000000003 109.52 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 65.7 m -56.48 112.39 1.25 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.546 . . . . 6.3700000000000001 110.961 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -107.93 -16.94 14.18 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.623 -0.717 . . . . 5.9000000000000004 110.407 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 36.9 t0 . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 108.902 -0.777 . . . . 5.6200000000000001 108.902 179.716 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.596 ' CE2' ' HB ' ' B' ' 8' ' ' THR . 92.3 m-85 . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 109.663 -0.495 . . . . 3.1299999999999999 109.663 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.9 mm -92.98 131.61 39.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.059 0.457 . . . . 2.2400000000000002 111.574 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.546 ' HZ2' ' HB3' ' A' ' 23' ' ' LYS . 4.3 ttpm? -110.45 118.79 37.2 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.083 -0.508 . . . . 3.7000000000000002 109.726 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -101.52 150.41 23.09 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.92 -0.582 . . . . 1.77 110.641 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HE3' ' NE2' ' A' ' 35' ' ' HIS . 31.9 mtpt -103.42 110.48 22.51 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.411 -0.589 . . . . 3.1299999999999999 109.411 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.1 t -88.46 125.13 41.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.262 -0.426 . . . . 1.76 110.517 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.543 ' HA ' ' O ' ' A' ' 32' ' ' SER . 35.2 mm -113.31 123.88 69.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.935 -0.575 . . . . 2.6000000000000001 110.625 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.38 177.53 40.95 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.937 -0.649 . . . . 2.6400000000000001 111.874 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -69.5 -27.76 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.571 0.185 . . . . 3.73 111.31 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -88.7 26.5 1.49 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.752 0.31 . . . . 3.2400000000000002 110.954 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m 61.64 34.77 17.45 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.316 0.579 . . . . 3.29 110.793 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.543 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -84.45 149.02 26.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.764 -0.653 . . . . 2.5 110.343 -179.714 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -131.43 120.04 22.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.183 -0.462 . . . . 3.0099999999999998 110.192 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.8 mm -131.55 139.47 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.359 -0.608 . . . . 2.3199999999999998 109.359 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.551 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 20.2 m170 -89.49 140.22 29.75 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.473 -0.566 . . . . 2.3999999999999999 109.473 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.549 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -127.93 106.55 9.17 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.537 -0.301 . . . . 1.9399999999999999 111.091 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 ttmt -79.26 103.49 9.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.116 -0.493 . . . . 3.0099999999999998 109.714 178.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 m -109.38 159.65 8.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.043 0.449 . . . . 2.0800000000000001 111.215 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -104.58 126.28 51.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.058 -0.519 . . . . 3.6299999999999999 109.94 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 57.2 ttp -76.57 84.71 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.102 -0.703 . . . . 3.4100000000000001 109.102 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.3 m 168.52 -36.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.5099999999999998 108.132 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.5 m -76.26 145.56 39.59 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.168 -0.924 . . . . 2.0 110.603 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -69.76 148.52 49.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.398 -0.365 . . . . 2.96 110.723 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -66.36 -15.07 62.99 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 2.3799999999999999 111.329 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 8.6 tptt -60.03 -39.55 86.26 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.528 -0.545 . . . . 2.7599999999999998 109.528 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -61.45 -42.62 99.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.195 -0.911 . . . . 2.54 110.683 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.49 -40.9 89.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.947 -0.569 . . . . 2.9900000000000002 110.49 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -64.15 -51.07 65.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 2.3900000000000001 112.251 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -63.08 -47.69 81.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.269 0.47 . . . . 1.8799999999999999 112.269 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.52 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 67.9 m -65.13 -32.48 74.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.818 0.303 . . . . 1.72 111.818 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.06 -40.21 90.71 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.018 -0.734 . . . . 1.8899999999999999 109.018 179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 74.4 m -64.39 -38.05 89.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.647 -0.706 . . . . 1.99 109.493 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.52 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 91.1 mt-30 -64.12 -41.39 97.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.772 -0.649 . . . . 2.1699999999999999 110.281 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.425 ' NH1' HG12 ' B' ' 5' ' ' ILE . 26.9 ttt180 -67.65 -38.76 84.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.463 -0.335 . . . . 2.4900000000000002 111.012 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -79.58 -9.92 59.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.53 -0.305 . . . . 2.4100000000000001 111.293 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.09 36.97 56.23 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 121.111 -0.566 . . . . 2.7400000000000002 112.496 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.74 151.55 71.03 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 110.482 -0.192 . . . . 2.9399999999999999 110.482 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -67.07 157.91 59.44 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.844 2.363 . . . . 3.0899999999999999 111.729 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.448 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 16.3 tpt -64.13 143.31 57.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.543 -0.299 . . . . 2.5899999999999999 111.055 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.448 ' HB2' ' O ' ' A' ' 59' ' ' MET . 5.0 m120 75.48 1.4 3.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.057 0.762 . . . . 3.7599999999999998 113.057 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.4 p -74.71 -26.48 59.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.238 0.542 . . . . 3.0800000000000001 109.683 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 44.6 mt -119.11 150.11 40.56 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.386 -0.825 . . . . 2.77 110.148 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.0 ptt-85 -113.06 142.13 46.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.005 -0.543 . . . . 3.5800000000000001 109.658 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -108.48 114.4 28.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.214 -0.448 . . . . 2.3999999999999999 109.805 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.6 mt -106.39 123.58 48.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.116 0.484 . . . . 3.6400000000000001 111.406 -178.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -124.5 111.43 15.69 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.679 -0.691 . . . . 2.9700000000000002 109.281 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 61.86 24.56 14.64 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.094 -0.503 . . . . 3.6400000000000001 111.347 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.68 73.56 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.551 -0.833 . . . . 3.7999999999999998 112.401 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -105.41 134.13 49.03 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.786 -0.449 . . . . 5.0899999999999999 109.786 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.09 131.2 37.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.325 0.584 . . . . 3.71 110.025 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.2 mm -68.24 111.47 2.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.536 -0.756 . . . . 2.5499999999999998 111.356 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.51 157.11 24.95 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.144 -0.48 . . . . 3.3799999999999999 110.348 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.409 ' CG ' ' HD3' ' A' ' 45' ' ' LYS . 85.3 m-20 -67.24 -26.34 66.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.114 -0.494 . . . . 2.5899999999999999 111.491 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -93.73 11.81 27.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.348 -0.387 . . . . 3.4500000000000002 111.46 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -91.49 157.02 17.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.123 0.487 . . . . 3.6200000000000001 110.832 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.56 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -137.48 157.76 73.32 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 2.9900000000000002 110.256 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.91 -19.35 61.99 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.696 2.264 . . . . 2.21 112.636 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -64.63 -35.94 82.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.905 0.383 . . . . 3.3500000000000001 110.888 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.5 pt-20 -94.99 176.88 6.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 3.1800000000000002 110.295 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 81.3 mt 70.13 -9.37 0.74 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.071 0.548 . . . . 3.2999999999999998 111.906 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 71.1 44.42 54.25 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.923 -0.656 . . . . 2.8799999999999999 111.99 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -70.56 138.62 51.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.505 0.193 . . . . 2.7000000000000002 110.628 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 42.0 mt-10 -127.42 170.12 12.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.797 0.332 . . . . 3.4399999999999999 110.619 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 20.8 tp10 -69.47 140.9 54.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.912 -0.586 . . . . 2.3399999999999999 109.473 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 31.5 mm-40 70.11 19.87 6.59 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.526 0.516 . . . . 2.6299999999999999 111.261 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.516 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.7 OUTLIER -73.82 160.94 30.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.975 -0.38 . . . . 2.2799999999999998 109.975 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 82.5 t -108.44 131.35 59.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.045 0.45 . . . . 2.6699999999999999 111.99 -178.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.2 tt -126.0 131.69 71.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.669 -0.863 . . . . 2.0800000000000001 108.669 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -102.88 137.54 40.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.813 0.339 . . . . 2.8999999999999999 111.7 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 5.4 p -121.2 126.61 75.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 2.3599999999999999 110.295 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -132.64 160.87 35.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.638 0.256 . . . . 3.0 111.081 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -81.07 135.53 35.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.264 -0.425 . . . . 3.8100000000000001 110.948 -179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -84.08 148.11 27.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.229 -0.441 . . . . 3.6099999999999999 109.952 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -66.94 -25.92 66.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.423 -0.353 . . . . 5.0499999999999998 111.655 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.27 -33.19 65.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.713 0.292 . . . . 4.6799999999999997 111.455 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.79 5.73 87.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.766 -0.73 . . . . 3.7999999999999998 112.024 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.868 0 CA-C-O 118.875 -0.958 . . . . 3.6800000000000002 111.91 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.587 0.232 . . . . 8.0399999999999991 110.602 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.9 m -76.4 150.01 6.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.11 -0.495 . . . . 3.1899999999999999 110.147 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -66.9 138.95 57.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.075 -0.511 . . . . 2.5 111.167 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.551 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 10.4 p -105.57 124.95 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-O 121.279 0.561 . . . . 2.73 110.382 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.549 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 5.7 mt -76.38 119.36 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 109.426 -0.583 . . . . 2.1699999999999999 109.426 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -83.54 105.93 14.86 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 120.676 0.274 . . . . 2.5299999999999998 110.617 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.464 HD22 ' CB ' ' A' ' 50' ' ' SER . 0.4 OUTLIER -134.17 23.38 3.82 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.138 0.494 . . . . 2.3199999999999998 110.657 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' THR . . . . . 0.596 ' HB ' ' CE2' ' A' ' 21' ' ' TYR . 73.1 p -77.18 55.25 1.16 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.846 -0.616 . . . . 3.3500000000000001 111.096 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . 0.495 HD13 ' O ' ' B' ' 11' ' ' SER . 2.7 pt -129.91 -173.06 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.022 -0.535 . . . . 4.3600000000000003 110.926 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -100.01 -53.46 3.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.055 -0.52 . . . . 6.2199999999999998 110.816 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' SER . . . . . 0.495 ' O ' HD13 ' B' ' 9' ' ' ILE . 1.9 p -117.02 162.74 17.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.526 -0.761 . . . . 5.8200000000000003 110.787 -179.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 18.5 m -62.8 -49.62 74.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.232 0.539 . . . . 6.3700000000000001 109.84 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.61 58.55 4.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.465 -0.789 . . . . 5.9000000000000004 109.675 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.742 -0.663 . . . . 5.6200000000000001 111.279 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 N--CA 1.481 1.111 0 N-CA-C 109.949 -0.389 . . . . 3.1299999999999999 109.949 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.1 mm -84.53 118.58 31.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 109.428 -0.582 . . . . 2.2400000000000002 109.428 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -93.47 118.66 31.6 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.063 0.459 . . . . 3.7000000000000002 110.938 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 94.0 mt -104.49 150.61 24.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.717 -0.674 . . . . 1.77 109.691 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -113.65 113.22 24.73 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.031 0.443 . . . . 3.1299999999999999 111.592 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.401 HG22 ' CG2' ' A' ' 88' ' ' ILE . 60.4 t -96.44 119.37 44.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.22 -0.659 . . . . 1.76 109.22 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.519 ' HA ' ' O ' ' A' ' 32' ' ' SER . 25.1 mm -100.62 120.39 50.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 2.6000000000000001 111.555 -178.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.61 171.0 42.92 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.263 -0.735 . . . . 2.6400000000000001 111.263 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.5 tp60 -69.58 -22.82 63.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.126 0.489 . . . . 3.73 110.867 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -85.85 15.26 5.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.977 -0.556 . . . . 3.2400000000000002 110.995 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 65.51 47.31 2.28 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.231 0.539 . . . . 3.29 111.43 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.519 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 13.3 p -111.6 136.06 51.33 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.351 -0.611 . . . . 2.5 109.351 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -115.6 94.96 4.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.992 0.425 . . . . 3.0099999999999998 110.559 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.5 mt -91.07 138.56 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.166 -0.47 . . . . 2.3199999999999998 110.235 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.631 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 33.4 m80 -92.12 138.74 31.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.88 -0.6 . . . . 2.3999999999999999 111.775 -178.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.423 ' HZ ' ' CD1' ' A' ' 51' ' ' TYR . 4.4 m-85 -126.17 106.69 9.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.795 -0.639 . . . . 1.9399999999999999 109.995 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' ASP . 23.9 mtmt -85.29 96.84 9.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.217 0.532 . . . . 3.0099999999999998 110.89 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.8 m -106.58 171.2 2.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.761 -0.654 . . . . 2.0800000000000001 110.785 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -128.06 141.17 51.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.32 -0.622 . . . . 3.6299999999999999 109.32 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 ttp -77.64 84.9 3.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.387 0.613 . . . . 3.4100000000000001 109.789 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 48.3 m -164.88 -51.59 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.92 -1.036 . . . . 2.5099999999999998 108.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.34 148.61 32.01 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.825 -1.079 . . . . 2.0 110.313 179.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -67.4 159.16 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.258 -0.428 . . . . 2.96 110.616 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.9 mt -69.29 -11.88 61.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.249 0.547 . . . . 2.3799999999999999 109.71 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.46 72.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.198 -0.91 . . . . 2.7599999999999998 109.216 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.5 tptt -60.31 -43.42 96.34 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.102 -0.954 . . . . 2.54 110.928 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.8 tt -64.8 -33.48 76.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.063 0.458 . . . . 2.9900000000000002 111.044 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -74.45 -36.7 63.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 2.3900000000000001 112.002 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 0.1 OUTLIER -82.24 -45.82 14.53 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.61 0.596 . . . . 1.8799999999999999 112.61 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 p -58.8 -45.53 89.66 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.328 0.492 . . . . 1.72 112.328 -178.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.423 ' CD1' ' HZ ' ' A' ' 36' ' ' PHE . 6.9 t80 -64.33 -36.2 83.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.72 -0.392 . . . . 1.8899999999999999 111.39 -179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.7 m -61.22 -39.42 90.19 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.091 0.472 . . . . 1.99 109.948 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -63.88 -44.28 93.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.744 . . . . 2.1699999999999999 110.391 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.72 -42.21 91.34 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.973 -0.558 . . . . 2.4900000000000002 110.837 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -69.2 -26.86 65.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.506 -0.315 . . . . 2.4100000000000001 110.903 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.61 33.18 10.4 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.8 -0.714 . . . . 2.7400000000000002 111.84 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 m -133.01 154.3 81.3 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.745 0.307 . . . . 2.9399999999999999 110.5 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.69 149.86 73.82 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.56 2.173 . . . . 3.0899999999999999 111.722 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.525 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 23.1 ttt -68.64 161.66 27.65 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.504 -0.317 . . . . 2.5899999999999999 110.242 179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 59' ' ' MET . 11.3 m120 78.53 -12.09 1.13 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.512 0.725 . . . . 3.7599999999999998 111.589 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -78.3 -31.24 48.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.341 0.591 . . . . 3.0800000000000001 109.515 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -108.84 131.66 54.77 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.438 -0.801 . . . . 2.77 110.1 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptt-85 -107.99 122.92 47.84 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 3.5800000000000001 110.086 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -88.3 125.11 34.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.964 -0.562 . . . . 2.3999999999999999 109.696 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.4 mt -110.06 131.64 54.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.986 -0.552 . . . . 3.6400000000000001 110.862 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -124.81 106.34 9.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.621 -0.718 . . . . 2.9700000000000002 109.291 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 64.35 33.2 11.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 3.6400000000000001 111.054 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.83 -21.07 45.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.815 -0.707 . . . . 3.7999999999999998 113.895 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -103.2 138.71 39.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.263 0.531 . . . . 5.0899999999999999 110.565 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -70.47 148.42 48.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.297 0.57 . . . . 3.71 111.061 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 29.5 mm -85.22 120.88 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.427 -0.806 . . . . 2.5499999999999998 111.533 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.87 156.52 24.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.962 -0.563 . . . . 3.3799999999999999 109.913 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -70.08 -27.03 64.29 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.267 -0.424 . . . . 2.5899999999999999 111.598 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -87.63 1.23 54.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.309 -0.405 . . . . 3.4500000000000002 111.234 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.467 ' HD1' HD13 ' A' ' 80' ' ' LEU . 8.7 m170 -85.16 144.92 27.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.045 0.45 . . . . 3.6200000000000001 110.858 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.471 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 41.8 p -120.99 161.63 39.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.709 -0.678 . . . . 2.9900000000000002 109.926 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.81 -3.08 7.5 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.666 2.244 . . . . 2.21 112.479 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -79.64 -35.5 39.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.955 -0.566 . . . . 3.3500000000000001 110.37 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.475 ' C ' ' H ' ' A' ' 81' ' ' GLY . 2.9 pt-20 -94.54 -179.57 4.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.185 -0.462 . . . . 3.1800000000000002 109.992 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.467 HD13 ' HD1' ' A' ' 75' ' ' HIS . 13.6 mt 73.05 -29.54 0.2 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.327 0.651 . . . . 3.2999999999999998 111.776 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 94.06 34.58 6.4 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.363 -0.695 . . . . 2.8799999999999999 111.363 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.2 ttm -65.7 128.76 37.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 2.7000000000000002 110.974 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -121.46 -177.65 3.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.987 -0.551 . . . . 3.4399999999999999 110.635 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -75.59 144.52 41.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.149 -0.478 . . . . 2.3399999999999999 110.275 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 62.1 27.05 16.31 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.582 0.551 . . . . 2.6299999999999999 110.584 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.68 140.64 40.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.544 . . . . 2.2799999999999998 110.602 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.8 t -90.38 127.28 42.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.708 -0.678 . . . . 2.6699999999999999 111.631 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.401 ' CG2' HG22 ' A' ' 26' ' ' VAL . 19.3 tt -125.68 139.97 49.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.61 -0.885 . . . . 2.0800000000000001 108.61 178.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -104.86 157.99 16.83 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.992 0.425 . . . . 2.8999999999999999 111.444 -178.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 p -141.19 121.91 12.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 2.3599999999999999 110.418 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -128.55 161.7 28.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.029 -0.532 . . . . 3.0 109.711 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -92.42 138.41 31.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 3.8100000000000001 110.955 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -72.36 142.67 48.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.892 -0.595 . . . . 3.6099999999999999 110.019 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -66.98 -34.41 77.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.393 -0.367 . . . . 5.0499999999999998 110.597 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -35.52 80.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.019 -0.537 . . . . 4.6799999999999997 111.408 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.24 -27.68 15.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.842 -0.694 . . . . 3.7999999999999998 111.902 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.874 0 CA-C-O 118.88 -0.955 . . . . 3.6800000000000002 111.749 179.745 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 84.6 mttt . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 110.026 -0.361 . . . . 8.0399999999999991 110.026 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.0 m -102.3 145.94 11.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.818 0.342 . . . . 3.1899999999999999 110.594 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -77.61 115.34 17.29 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.496 -0.557 . . . . 2.5 109.496 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.631 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 7.4 p -84.85 121.62 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.89 0 N-CA-C 109.278 -0.638 . . . . 2.73 109.278 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -90.58 109.61 21.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.829 -0.623 . . . . 2.1699999999999999 110.757 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . 0.422 ' HA ' ' O ' ' A' ' 37' ' ' LYS . 1.8 m-20 -76.46 117.95 18.64 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 116.058 -0.519 . . . . 2.5299999999999998 109.757 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 13.1 mt -123.33 36.98 4.52 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.45 0.643 . . . . 2.3199999999999998 110.033 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 3.4 t -69.21 -19.5 63.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.307 -0.86 . . . . 3.3500000000000001 111.563 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 2.0 pt -124.88 154.55 32.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.448 -0.342 . . . . 4.3600000000000003 110.96 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -76.32 -36.36 58.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.471 0.653 . . . . 6.2199999999999998 109.549 179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 5.6 m -124.38 127.3 47.36 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.778 -0.647 . . . . 5.8200000000000003 110.086 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 9.7 m -53.94 121.02 7.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.074 0.464 . . . . 6.3700000000000001 110.786 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.6 m -116.13 22.08 13.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.104 0.478 . . . . 5.9000000000000004 110.689 -179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 1.2 t70 . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.856 -0.611 . . . . 5.6200000000000001 109.608 179.861 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.579 ' CE2' ' HB ' ' B' ' 8' ' ' THR . 95.8 m-85 . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 110.001 -0.37 . . . . 3.1299999999999999 110.001 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.3 mm -74.64 129.52 36.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 116.464 -0.334 . . . . 2.2400000000000002 110.118 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 tttt -103.39 119.76 39.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.164 0.507 . . . . 3.7000000000000002 111.364 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.0 mt -106.33 150.25 26.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.561 -0.745 . . . . 1.77 109.537 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -104.74 106.57 17.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.432 -0.349 . . . . 3.1299999999999999 110.581 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.01 123.02 37.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.202 -0.666 . . . . 1.76 109.202 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 89' ' ' GLU . 48.1 mm -117.92 108.57 24.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.013 0.435 . . . . 2.6000000000000001 110.625 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.28 170.13 50.42 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.582 -0.818 . . . . 2.6400000000000001 111.29 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -64.99 -27.69 69.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.14 0.495 . . . . 3.73 110.731 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.516 ' CG ' ' HG ' ' A' ' 32' ' ' SER . 7.2 p-10 -89.15 25.41 1.87 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.686 -0.688 . . . . 3.2400000000000002 111.411 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.8 m 60.11 33.84 21.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.167 0.508 . . . . 3.29 111.839 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.516 ' HG ' ' CG ' ' A' ' 30' ' ' ASP . 0.1 OUTLIER -87.42 114.11 23.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.991 -0.55 . . . . 2.5 109.739 179.151 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.7 ' O ' HG11 ' B' ' 2' ' ' VAL . 3.7 mt-10 -101.37 108.75 20.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.609 -0.515 . . . . 3.0099999999999998 109.609 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.8 mm -115.66 144.43 23.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.567 0.223 . . . . 2.3199999999999998 110.41 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -89.06 141.78 28.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.916 0.389 . . . . 2.3999999999999999 110.391 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.485 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -133.79 104.41 6.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 1.9399999999999999 111.063 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -91.01 106.75 18.74 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.254 0.55 . . . . 3.0099999999999998 110.982 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 18.0 m -111.83 170.46 3.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.689 -0.687 . . . . 2.0800000000000001 111.249 -179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.472 ' HE2' ' OG1' ' A' ' 42' ' ' THR . 16.1 pttm -119.16 138.67 52.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.989 -0.55 . . . . 3.6299999999999999 109.922 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.461 ' C ' ' HG1' ' A' ' 41' ' ' THR . 42.7 tpp -75.1 84.71 2.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.125 0.488 . . . . 3.4100000000000001 110.141 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.461 ' HG1' ' C ' ' A' ' 40' ' ' MET . 0.5 OUTLIER -166.3 -55.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 2.5099999999999998 109.369 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.472 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 0.8 OUTLIER -79.09 147.64 32.7 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.126 -0.943 . . . . 2.0 110.841 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -70.19 173.51 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.236 -0.653 . . . . 2.96 109.236 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.01 3.89 6.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.246 0.546 . . . . 2.3799999999999999 110.139 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.4 tptt -60.24 -46.2 90.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.102 -0.953 . . . . 2.7599999999999998 109.208 177.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -65.24 -38.48 90.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.888 -1.051 . . . . 2.54 110.037 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.93 -46.15 71.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.815 -0.63 . . . . 2.9900000000000002 110.581 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.421 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 53.7 mtpt -70.05 -54.67 12.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.725 -0.67 . . . . 2.3900000000000001 112.647 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -43.62 79.79 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.198 0.814 . . . . 1.8799999999999999 113.198 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.8 m -63.47 -37.1 86.0 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.327 -0.233 . . . . 1.72 111.537 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -67.17 -43.68 81.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.636 -0.426 . . . . 1.8899999999999999 109.915 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.66 -37.65 82.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.01 0.433 . . . . 1.99 110.303 179.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -60.39 -43.08 96.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.825 -0.625 . . . . 2.1699999999999999 110.518 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.18 -28.78 61.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.326 -0.397 . . . . 2.4900000000000002 110.888 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -74.92 -19.68 60.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.511 -0.313 . . . . 2.4100000000000001 111.184 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.64 25.38 42.5 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.609 -0.805 . . . . 2.7400000000000002 112.288 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 7.0 m -127.73 154.7 77.91 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 110.07 -0.345 . . . . 2.9399999999999999 110.07 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.38 161.91 44.28 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.283 1.988 . . . . 3.0899999999999999 111.771 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.06 153.36 43.9 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.292 -0.413 . . . . 2.5899999999999999 110.664 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t30 74.96 5.97 4.32 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.612 0.765 . . . . 3.7599999999999998 112.069 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.5 p -88.81 -26.01 21.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.263 0.554 . . . . 3.0800000000000001 109.698 178.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -115.5 146.22 41.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.47 -0.786 . . . . 2.77 110.24 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.5 ptt-85 -119.0 133.99 55.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.401 -0.592 . . . . 3.5800000000000001 109.401 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.421 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 96.2 m-85 -102.65 128.05 49.5 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.069 -0.514 . . . . 2.3999999999999999 109.906 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.9 mt -110.35 133.45 53.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.378 0.609 . . . . 3.6400000000000001 111.546 -179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -124.95 105.55 9.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.106 -0.952 . . . . 2.9700000000000002 108.508 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 63.95 22.68 13.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.862 -0.608 . . . . 3.6400000000000001 110.87 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.17 -25.75 26.13 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.973 -0.632 . . . . 3.7999999999999998 112.678 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -87.36 143.07 27.43 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.099 -0.334 . . . . 5.0899999999999999 110.099 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -82.16 140.33 33.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.257 0.551 . . . . 3.71 110.706 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.6 mm -78.56 116.14 21.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.559 -0.746 . . . . 2.5499999999999998 111.082 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.57 26.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.016 -0.538 . . . . 3.3799999999999999 110.39 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.1 m-20 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.227 -0.442 . . . . 2.5899999999999999 111.222 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -92.21 -2.52 56.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.498 -0.319 . . . . 3.4500000000000002 111.68 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.2 m170 -67.35 143.89 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.765 0.317 . . . . 3.6200000000000001 110.877 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 75.6 p -120.27 155.84 55.67 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 116.307 -0.406 . . . . 2.9900000000000002 110.615 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.01 -11.05 28.69 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.39 2.06 . . . . 2.21 111.212 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -78.89 -38.92 36.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.504 -0.771 . . . . 3.3500000000000001 110.274 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 10.0 pt-20 -86.49 -179.15 6.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.462 -0.335 . . . . 3.1800000000000002 110.41 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 9.0 mt 72.07 -54.75 0.68 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.225 0.61 . . . . 3.2999999999999998 111.674 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.85 36.36 0.67 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.673 -0.571 . . . . 2.8799999999999999 111.673 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.07 132.37 45.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.9 0.381 . . . . 2.7000000000000002 110.453 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -124.79 -168.74 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.12 0.486 . . . . 3.4399999999999999 111.485 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -76.24 143.76 40.79 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.518 -0.764 . . . . 2.3399999999999999 109.681 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 60.59 28.12 17.81 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.421 . . . . 2.6299999999999999 110.893 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.92 147.15 43.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 2.2799999999999998 110.153 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 17.6 t -96.09 128.32 47.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.234 0.54 . . . . 2.6699999999999999 111.708 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.8 tt -125.57 112.81 32.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.742 -0.836 . . . . 2.0800000000000001 108.742 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.467 ' HA ' ' O ' ' A' ' 27' ' ' ILE . 75.8 mt-10 -88.64 141.45 28.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.736 -0.666 . . . . 2.8999999999999999 111.181 -178.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.41 137.52 53.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.075 -0.511 . . . . 2.3599999999999999 110.349 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -137.12 163.36 31.01 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.557 -0.534 . . . . 3.0 109.557 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -95.81 139.43 32.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.686 0.279 . . . . 3.8100000000000001 110.48 -179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -79.17 149.34 32.01 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 3.6099999999999999 110.289 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -58.59 -45.5 88.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 5.0499999999999998 110.841 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.7 p -72.05 -32.75 67.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.056 -0.52 . . . . 4.6799999999999997 110.277 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.73 15.04 70.78 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.682 -0.69 . . . . 3.7999999999999998 112.296 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.936 0 N-CA-C 110.922 -0.871 . . . . 3.6800000000000002 110.922 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 110.182 -0.303 . . . . 8.0399999999999991 110.182 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.7 HG11 ' O ' ' A' ' 33' ' ' GLU . 12.0 t -77.01 150.2 6.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.213 -0.449 . . . . 3.1899999999999999 110.273 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -67.47 138.04 56.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.03 -0.532 . . . . 2.5 110.243 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 15.0 p -106.17 127.59 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-O 121.433 0.635 . . . . 2.73 110.94 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.485 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 18.4 mt -87.55 108.52 18.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.828 -0.624 . . . . 2.1699999999999999 109.502 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -79.67 134.42 36.42 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.79 -0.448 . . . . 2.5299999999999998 109.79 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 18.2 mt -119.35 27.25 8.91 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.479 0.657 . . . . 2.3199999999999998 109.989 178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' THR . . . . . 0.579 ' HB ' ' CE2' ' A' ' 21' ' ' TYR . 1.4 t -74.9 -41.25 60.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.489 -0.778 . . . . 3.3500000000000001 110.545 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 39.1 mm -66.47 116.6 5.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.086 -0.506 . . . . 4.3600000000000003 111.398 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -144.24 -67.43 0.33 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.684 -0.689 . . . . 6.2199999999999998 110.054 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 14.3 m -107.62 153.67 22.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.931 -0.577 . . . . 5.8200000000000003 109.722 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 41.8 m -55.37 108.22 0.4 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 6.3700000000000001 111.189 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 4.4 p -165.53 -23.62 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.79 -0.641 . . . . 5.9000000000000004 111.762 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 19.0 t70 . . . . . 0 N--CA 1.463 0.216 0 C-N-CA 120.9 -0.32 . . . . 5.6200000000000001 110.975 -179.583 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.49 ' OH ' ' HA ' ' B' ' 10' ' ' GLU . 9.1 m-85 . . . . . 0 N--CA 1.48 1.056 0 N-CA-C 110.096 -0.335 . . . . 3.1299999999999999 110.096 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.9 mm -73.68 128.96 36.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.149 -0.478 . . . . 2.2400000000000002 109.994 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.586 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 35.6 ttpt -112.43 118.59 35.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.442 -0.345 . . . . 3.7000000000000002 110.204 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.3 mt -102.67 150.29 23.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.334 -0.394 . . . . 1.77 110.039 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -107.82 111.45 23.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.782 0.325 . . . . 3.1299999999999999 111.173 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 20.2 t -90.06 104.35 15.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.129 -0.693 . . . . 1.76 109.129 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.76 114.93 30.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.066 0.46 . . . . 2.6000000000000001 111.47 -178.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 170.05 34.56 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.771 -0.65 . . . . 2.6400000000000001 111.949 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -71.85 -16.59 62.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.135 0.493 . . . . 3.73 110.9 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -91.69 15.03 13.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.486 . . . . 3.2400000000000002 110.747 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.9 m 68.14 30.17 5.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.582 -0.735 . . . . 3.29 111.708 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 55.7 p -99.18 140.69 32.96 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.494 -0.558 . . . . 2.5 109.494 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.417 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 5.0 pt-20 -125.71 92.57 3.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.133 0.492 . . . . 3.0099999999999998 110.939 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.448 HG22 HD11 ' A' ' 34' ' ' ILE . 6.6 mm -81.22 139.3 18.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.767 -0.827 . . . . 2.3199999999999998 108.767 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -95.64 147.61 23.4 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.871 -0.332 . . . . 2.3999999999999999 110.32 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.586 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -125.62 117.11 22.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.324 -0.398 . . . . 1.9399999999999999 111.164 -179.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.457 ' N ' HG12 ' B' ' 4' ' ' VAL . 3.6 mtmt -96.68 96.11 8.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.136 0.493 . . . . 3.0099999999999998 110.818 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 16.2 m -118.29 170.88 7.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.733 . . . . 2.0800000000000001 111.35 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.89 147.0 50.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.932 -0.766 . . . . 3.6299999999999999 108.932 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.638 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 23.1 mmt -69.39 86.2 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.209 0.528 . . . . 3.4100000000000001 110.672 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.1 m -164.53 -52.32 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.529 -0.76 . . . . 2.5099999999999998 109.622 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.05 147.66 34.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.261 -0.881 . . . . 2.0 111.484 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -69.37 165.58 20.46 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.154 -0.475 . . . . 2.96 110.586 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.2 mt -70.99 -9.92 58.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.149 0.499 . . . . 2.3799999999999999 110.564 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.41 ' HG3' ' OD2' ' A' ' 73' ' ' ASP . 40.3 tttp -63.49 -38.01 89.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.236 -0.653 . . . . 2.7599999999999998 109.236 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -61.76 -36.38 80.87 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.316 -0.857 . . . . 2.54 110.218 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.21 -39.52 94.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.603 -0.726 . . . . 2.9900000000000002 110.391 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -70.6 -52.45 21.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.38 -0.827 . . . . 2.3900000000000001 112.206 -178.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.466 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 4.4 pt-20 -65.27 -47.04 78.08 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.884 0.698 . . . . 1.8799999999999999 112.884 -177.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.459 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 13.0 m -59.79 -39.26 84.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.711 0.291 . . . . 1.72 111.777 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -69.28 -41.06 77.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.632 -0.427 . . . . 1.8899999999999999 110.298 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.72 -40.78 96.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.327 -0.397 . . . . 1.99 110.634 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 92.9 mt-30 -62.07 -41.78 98.52 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.226 0.536 . . . . 2.1699999999999999 109.955 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.447 ' NH1' HG12 ' B' ' 5' ' ' ILE . 23.4 ttt180 -64.86 -43.81 91.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.846 -0.615 . . . . 2.4900000000000002 110.573 179.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -69.39 -25.33 64.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 2.4100000000000001 110.466 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.71 40.36 8.28 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 111.224 -0.75 . . . . 2.7400000000000002 111.224 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.4 m -135.99 155.75 77.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.292 . . . . 2.9399999999999999 110.21 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.45 148.46 92.62 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.87 2.38 . . . . 3.0899999999999999 112.126 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.463 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 12.6 ttt -76.44 61.32 1.7 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.498 0.666 . . . . 2.5899999999999999 110.883 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -170.1 -18.36 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.446 -0.797 . . . . 3.7599999999999998 109.735 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 m -82.31 -12.05 58.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 3.0800000000000001 111.583 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 64.2 mt -121.64 139.32 53.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.05 0.453 . . . . 2.77 111.177 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.403 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 19.9 ptt-85 -118.15 129.0 55.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.993 -0.549 . . . . 3.5800000000000001 109.565 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -97.68 126.98 43.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.982 -0.553 . . . . 2.3999999999999999 110.309 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 81.9 mt -113.88 137.12 52.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 3.6400000000000001 110.851 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -127.17 100.38 6.07 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.495 -0.928 . . . . 2.9700000000000002 108.495 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 65.55 31.79 9.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.634 -0.712 . . . . 3.6400000000000001 110.555 -179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.74 -28.04 15.24 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.733 -0.667 . . . . 3.7999999999999998 112.701 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -87.71 135.4 33.39 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.225 -0.287 . . . . 5.0899999999999999 110.225 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -75.56 142.16 42.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.469 0.652 . . . . 3.71 111.328 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 30.3 mm -79.59 117.38 25.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.268 -0.878 . . . . 2.5499999999999998 110.925 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.441 ' HB2' ' ND1' ' A' ' 75' ' ' HIS . . . -84.81 154.9 22.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.048 -0.524 . . . . 3.3799999999999999 110.229 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.41 ' OD2' ' HG3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -66.99 -27.75 67.69 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.993 -0.548 . . . . 2.5899999999999999 111.744 -179.051 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -89.4 4.25 49.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 3.4500000000000002 111.503 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.441 ' ND1' ' HB2' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -86.37 149.16 25.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.336 0.589 . . . . 3.6200000000000001 111.378 -179.35 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.1 p -117.42 157.95 46.11 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.502 -0.772 . . . . 2.9900000000000002 110.09 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.638 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 17.0 Cg_exo -67.0 -10.71 29.54 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.441 2.094 . . . . 2.21 111.952 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -79.46 -17.56 53.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.366 0.603 . . . . 3.3500000000000001 109.79 179.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -98.01 164.14 12.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.661 -0.699 . . . . 3.1800000000000002 110.26 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 86.6 mt 68.68 -1.13 2.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.888 -0.597 . . . . 3.2999999999999998 111.944 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.07 45.53 55.96 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.81 -0.71 . . . . 2.8799999999999999 112.868 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 3.6 ttt -72.53 125.4 27.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.811 0.338 . . . . 2.7000000000000002 110.229 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -114.18 -171.53 1.93 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.467 0.543 . . . . 3.4399999999999999 112.467 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.94 137.45 45.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.499 -0.773 . . . . 2.3399999999999999 110.229 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 54.76 38.7 30.61 Favored 'General case' 0 CA--C 1.516 -0.348 0 O-C-N 123.797 0.686 . . . . 2.6299999999999999 110.863 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.02 160.11 33.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.609 -0.723 . . . . 2.2799999999999998 110.404 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 99.3 t -99.16 114.06 35.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.394 0.616 . . . . 2.6699999999999999 112.208 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -120.32 132.31 70.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 108.277 -1.008 . . . . 2.0800000000000001 108.277 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -111.66 144.05 41.57 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.916 0.389 . . . . 2.8999999999999999 111.28 -178.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.62 129.54 73.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.078 -0.51 . . . . 2.3599999999999999 110.421 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -130.92 159.72 36.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.23 -0.441 . . . . 3.0 110.121 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -79.95 139.59 37.0 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.864 0.364 . . . . 3.8100000000000001 111.026 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.403 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.4 mm-40 -77.38 149.83 35.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.914 -0.585 . . . . 3.6099999999999999 110.855 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -73.17 -32.68 64.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.874 -0.603 . . . . 5.0499999999999998 110.317 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 p -65.18 -57.18 9.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.908 -0.587 . . . . 4.6799999999999997 110.128 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.35 -20.31 18.82 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.756 -0.656 . . . . 3.7999999999999998 112.493 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.75 -1.028 . . . . 3.6800000000000002 111.807 -179.904 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.748 0.309 . . . . 8.0399999999999991 110.424 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 46.5 t -76.85 149.26 6.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.238 -0.437 . . . . 3.1899999999999999 110.655 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.61 148.28 51.61 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.803 -0.635 . . . . 2.5 111.426 -179.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.457 HG12 ' N ' ' A' ' 37' ' ' LYS . 2.2 t -99.16 120.12 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-N 115.517 -0.765 . . . . 2.73 109.671 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.469 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 9.6 mt -71.77 108.71 3.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 2.1699999999999999 109.707 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -73.94 107.6 6.26 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 116.157 -0.474 . . . . 2.5299999999999998 110.466 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 12.0 mt -100.88 -20.03 15.66 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 119.455 -0.898 . . . . 2.3199999999999998 109.966 178.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 1.7 m -122.62 124.31 43.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.767 -0.651 . . . . 3.3500000000000001 110.343 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 7.6 tp -74.58 147.36 8.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.958 -0.565 . . . . 4.3600000000000003 110.889 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . 0.49 ' HA ' ' OH ' ' A' ' 21' ' ' TYR . 42.6 mt-10 -81.28 -51.66 8.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.992 0.425 . . . . 6.2199999999999998 110.72 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.28 162.06 28.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.826 -0.625 . . . . 5.8200000000000003 110.867 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.95 -52.41 4.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.773 0.32 . . . . 6.3700000000000001 111.377 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 5.4 m -88.32 -28.61 20.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.486 -0.324 . . . . 5.9000000000000004 111.251 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 t70 . . . . . 0 C--N 1.324 -0.543 0 CA-C-O 120.929 0.395 . . . . 5.6200000000000001 110.223 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.454 ' CD1' HG22 ' B' ' 8' ' ' THR . 9.6 m-85 . . . . . 0 N--CA 1.483 1.216 0 N-CA-C 110.09 -0.337 . . . . 3.1299999999999999 110.09 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm -95.27 131.57 41.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.622 -0.51 . . . . 2.2400000000000002 109.622 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.703 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -102.5 145.84 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.157 0.503 . . . . 3.7000000000000002 111.689 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.0 mt -131.0 128.86 41.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.493 -0.776 . . . . 1.77 109.26 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -93.78 109.91 21.57 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.847 0.356 . . . . 3.1299999999999999 110.464 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 12.4 t -85.55 123.2 39.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.76 110.747 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.6 mm -109.93 116.7 52.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.685 -0.689 . . . . 2.6000000000000001 110.117 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.65 -179.93 43.33 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 2.6400000000000001 112.275 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -65.88 -28.48 68.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 3.73 110.617 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -86.21 13.56 7.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.107 -0.497 . . . . 3.2400000000000002 110.606 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m 59.78 48.63 8.93 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.833 0.825 . . . . 3.29 110.327 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.57 166.42 16.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.954 -1.021 . . . . 2.5 109.815 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' B' ' 2' ' ' VAL . 8.9 tt0 -137.53 97.07 3.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.023 0.44 . . . . 3.0099999999999998 110.243 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.7 mm -116.23 127.63 73.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.554 . . . . 2.3199999999999998 109.58 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.521 ' HB3' ' CG1' ' B' ' 4' ' ' VAL . 0.0 OUTLIER -88.81 166.67 13.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.141 0.495 . . . . 2.3999999999999999 110.826 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.703 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -143.39 131.11 21.36 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 122.246 -0.284 . . . . 1.9399999999999999 111.71 -179.062 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -99.09 95.2 6.96 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.061 -0.348 . . . . 3.0099999999999998 110.061 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.9 m -117.35 171.58 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 2.0800000000000001 111.465 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.63 148.35 50.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.542 -0.54 . . . . 3.6299999999999999 109.542 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.477 ' C ' ' HG1' ' A' ' 41' ' ' THR . 26.6 mtt -83.96 85.33 7.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.225 0.536 . . . . 3.4100000000000001 111.032 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.477 ' HG1' ' C ' ' A' ' 40' ' ' MET . 16.3 m -167.74 -46.9 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.294 -1.002 . . . . 2.5099999999999998 108.294 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.52 148.07 37.35 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.716 -1.129 . . . . 2.0 110.882 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -66.67 155.27 38.43 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.295 -0.412 . . . . 2.96 110.648 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.8 mt -69.5 -9.96 56.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.449 . . . . 2.3799999999999999 110.3 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.549 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 17.8 ttpp -61.51 -40.23 93.87 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.486 -0.779 . . . . 2.7599999999999998 109.103 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.3 tptp -62.6 -39.87 95.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.349 -0.841 . . . . 2.54 109.95 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.13 -44.39 87.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 2.9900000000000002 110.201 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -68.88 -54.59 14.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.604 -0.726 . . . . 2.3900000000000001 112.356 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.4 pt-20 -62.67 -42.58 99.69 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.788 0.662 . . . . 1.8799999999999999 112.788 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.494 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 9.4 m -65.67 -34.54 78.45 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.816 -0.354 . . . . 1.72 111.22 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.485 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 7.0 t80 -70.87 -40.69 72.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.525 -0.546 . . . . 1.8899999999999999 109.525 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 79.8 m -61.5 -35.22 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 1.99 109.896 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.494 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 72.8 mt-30 -63.44 -38.12 89.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.69 -0.686 . . . . 2.1699999999999999 110.363 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.437 ' NH1' HG12 ' B' ' 5' ' ' ILE . 2.4 ttt180 -76.05 -38.45 57.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.367 -0.379 . . . . 2.4900000000000002 110.334 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 10.8 mm100 -69.61 -22.79 63.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.063 0.459 . . . . 2.4100000000000001 110.251 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.28 27.24 40.69 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.005 -0.617 . . . . 2.7400000000000002 112.506 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.2 m -117.56 153.13 50.36 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.547 0.213 . . . . 2.9399999999999999 110.814 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.79 173.97 11.1 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.399 2.066 . . . . 3.0899999999999999 111.836 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.4 tpt -74.57 148.94 40.37 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.649 -0.25 . . . . 2.5899999999999999 110.753 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 70.06 16.72 7.48 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.636 -0.711 . . . . 3.7599999999999998 112.167 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.5 p -92.42 -26.62 17.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.242 0.544 . . . . 3.0800000000000001 109.698 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.7 mt -121.22 146.28 46.96 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.579 -0.737 . . . . 2.77 110.227 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.44 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.5 ptt-85 -119.3 131.26 55.72 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.142 -0.688 . . . . 3.5800000000000001 109.142 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.1 m-85 -99.87 133.83 43.66 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.964 -0.562 . . . . 2.3999999999999999 110.675 -178.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.7 mt -115.89 131.74 56.85 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.961 -0.563 . . . . 3.6400000000000001 110.665 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -134.97 114.49 12.55 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.424 -0.807 . . . . 2.9700000000000002 109.069 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 62.98 23.2 13.89 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.09 0.472 . . . . 3.6400000000000001 110.798 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.42 -12.55 68.74 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.953 -0.642 . . . . 3.7999999999999998 112.452 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -103.51 138.48 40.16 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.663 -0.316 . . . . 5.0899999999999999 110.279 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.2 ptm180 -76.28 142.37 41.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.136 0.493 . . . . 3.71 110.476 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.3 mm -75.75 117.8 20.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.798 -0.637 . . . . 2.5499999999999998 111.811 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.32 157.39 18.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.663 -0.698 . . . . 3.3799999999999999 109.64 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -67.85 -29.08 68.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.317 0.58 . . . . 2.5899999999999999 110.629 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -82.73 -4.42 57.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.697 -0.683 . . . . 3.4500000000000002 111.177 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -81.76 145.46 30.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.105 0.479 . . . . 3.6200000000000001 111.058 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.419 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 21.1 p -127.47 161.07 56.98 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 2.9900000000000002 109.7 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -65.39 -11.5 30.55 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.367 2.045 . . . . 2.21 111.923 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.41 -36.17 71.24 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.829 -0.623 . . . . 3.3500000000000001 110.313 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 4.2 pt-20 -97.95 -178.68 4.16 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.433 -0.581 . . . . 3.1800000000000002 109.433 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 23.7 mt 73.92 -49.94 0.68 Allowed 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.666 0.604 . . . . 3.2999999999999998 110.896 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.06 50.74 0.62 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.998 -0.62 . . . . 2.8799999999999999 112.137 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 33.3 mtt -77.39 137.23 38.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.36 . . . . 2.7000000000000002 110.778 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -122.79 174.13 7.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.11 -0.496 . . . . 3.4399999999999999 110.465 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -63.98 129.03 38.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 2.3399999999999999 110.898 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 58.26 49.36 11.26 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.295 0.569 . . . . 2.6299999999999999 110.879 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -79.31 178.58 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.652 -0.703 . . . . 2.2799999999999998 110.232 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.3 t -117.74 131.79 69.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.834 0.35 . . . . 2.6699999999999999 111.181 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 17.0 tt -134.81 132.5 53.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.288 -0.634 . . . . 2.0800000000000001 109.288 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -98.42 151.69 20.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.77 0.319 . . . . 2.8999999999999999 111.466 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -131.32 127.02 59.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.045 -0.525 . . . . 2.3599999999999999 110.353 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.05 160.54 35.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.949 -0.569 . . . . 3.0 109.823 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -85.65 145.55 27.26 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.874 0.368 . . . . 3.8100000000000001 110.945 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.44 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.2 mm-40 -84.62 133.27 34.42 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.179 -0.464 . . . . 3.6099999999999999 110.91 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -64.6 -28.47 69.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.859 -0.61 . . . . 5.0499999999999998 110.353 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -15.87 63.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 4.6799999999999997 111.458 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.07 -55.04 3.28 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.004 -0.617 . . . . 3.7999999999999998 112.104 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.627 -1.096 . . . . 3.6800000000000002 111.518 179.903 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.653 0.263 . . . . 8.0399999999999991 110.409 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . 0.499 HG12 ' N ' ' A' ' 35' ' ' HIS . 0.4 OUTLIER -102.97 106.67 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 N-CA-C 109.397 -0.594 . . . . 3.1899999999999999 109.397 179.67 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -97.97 128.76 44.73 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.745 -0.662 . . . . 2.5 110.16 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.521 ' CG1' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -85.14 106.74 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.614 0 N-CA-C 109.879 -0.415 . . . . 2.73 109.879 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.575 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 23.4 mt -69.93 122.0 20.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 109.073 -0.714 . . . . 2.1699999999999999 109.073 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -70.26 106.71 3.43 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.688 -0.687 . . . . 2.5299999999999998 111.836 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 8.4 mt -118.01 -14.2 9.99 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.502 -0.555 . . . . 2.3199999999999998 109.502 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' THR . . . . . 0.454 HG22 ' CD1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -83.8 20.07 1.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.929 -0.578 . . . . 3.3500000000000001 111.238 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 40.5 pt -66.74 -33.82 65.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.181 0.515 . . . . 4.3600000000000003 109.769 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -103.06 101.56 11.54 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.604 -0.725 . . . . 6.2199999999999998 109.906 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 3.0 t -132.61 -54.71 0.95 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.783 -0.644 . . . . 5.8200000000000003 109.608 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 58.6 m -122.92 -13.39 7.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.965 0.412 . . . . 6.3700000000000001 110.879 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.4 m -126.37 153.92 44.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.315 -0.402 . . . . 5.9000000000000004 110.334 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.037 -0.529 . . . . 5.6200000000000001 110.9 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 109.822 -0.436 . . . . 3.1299999999999999 109.822 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.421 ' O ' HG21 ' A' ' 38' ' ' VAL . 45.1 mm -75.31 130.38 36.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.913 0.387 . . . . 2.2400000000000002 110.901 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -110.23 126.81 54.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.872 0.368 . . . . 3.7000000000000002 110.62 179.124 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 71.9 mt -104.38 132.77 50.26 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.242 -0.651 . . . . 1.77 109.242 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 86' ' ' ASP . 1.7 ptpm? -99.5 113.42 25.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 3.1299999999999999 110.598 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.646 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.2 t -83.41 121.1 35.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.064 -0.971 . . . . 1.76 110.003 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.528 ' HA ' ' O ' ' A' ' 32' ' ' SER . 43.2 mm -105.78 124.76 61.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.254 -0.43 . . . . 2.6000000000000001 110.946 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.4 178.82 35.76 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.826 -0.624 . . . . 2.6400000000000001 112.187 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -70.01 -31.03 68.49 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 3.73 111.03 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -87.61 24.46 1.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.937 0.399 . . . . 3.2400000000000002 111.085 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.5 m 62.01 37.96 14.51 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.636 -0.711 . . . . 3.29 111.649 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 1.2 p -91.07 145.96 24.25 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.212 -0.449 . . . . 2.5 110.363 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -127.76 118.8 24.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.978 0.418 . . . . 3.0099999999999998 110.315 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.2 mt -120.27 130.57 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 2.3199999999999998 109.482 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.659 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 14.6 m170 -88.21 148.53 24.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.508 . . . . 2.3999999999999999 110.987 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.49 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -133.65 113.09 11.99 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.135 -0.484 . . . . 1.9399999999999999 110.852 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -81.36 101.42 9.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 3.0099999999999998 110.431 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.421 HG21 ' O ' ' A' ' 22' ' ' ILE . 5.3 m -108.06 156.88 8.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.361 . . . . 2.0800000000000001 110.718 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -113.83 129.66 56.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.193 -0.458 . . . . 3.6299999999999999 109.89 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.431 ' C ' ' HG1' ' A' ' 41' ' ' THR . 55.7 ttp -71.44 85.53 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.287 0.565 . . . . 3.4100000000000001 110.263 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.431 ' HG1' ' C ' ' A' ' 40' ' ' MET . 21.8 m -165.04 -59.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.33 -0.85 . . . . 2.5099999999999998 109.082 179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 149.45 29.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.346 -0.843 . . . . 2.0 111.134 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.71 -178.92 2.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.154 -0.475 . . . . 2.96 110.37 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.5 mt -78.34 -3.37 42.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.438 -0.346 . . . . 2.3799999999999999 111.27 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -61.73 -53.24 58.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.991 0.424 . . . . 2.7599999999999998 110.179 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -65.43 -36.16 83.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.874 -0.603 . . . . 2.54 110.721 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.62 -43.34 99.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.916 -0.583 . . . . 2.9900000000000002 111.274 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -66.64 -50.34 63.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.209 0.448 . . . . 2.3900000000000001 112.209 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -64.55 -43.53 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.68 0.622 . . . . 1.8799999999999999 112.68 -178.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 m -64.62 -33.07 75.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.61 0.243 . . . . 1.72 111.361 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -68.6 -42.46 78.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.907 -0.405 . . . . 1.8899999999999999 109.907 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.34 -35.33 78.76 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 1.99 110.809 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.4 -35.85 82.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 2.1699999999999999 110.453 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -72.17 -34.54 68.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 2.4900000000000002 110.76 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -81.31 -13.62 58.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 2.4100000000000001 110.497 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.09 39.67 44.64 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.163 -0.542 . . . . 2.7400000000000002 112.63 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.6 m -137.5 156.0 75.14 Favored Pre-proline 0 C--N 1.328 -0.351 0 N-CA-C 110.408 -0.219 . . . . 2.9399999999999999 110.408 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.31 146.8 90.61 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.666 2.244 . . . . 3.0899999999999999 112.645 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 5.2 ttt -78.5 55.29 1.59 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.892 -0.594 . . . . 2.5899999999999999 111.097 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -156.87 -16.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.112 -0.494 . . . . 3.7599999999999998 111.167 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.7 p -96.62 -8.61 31.25 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.119 -0.232 . . . . 3.0800000000000001 111.256 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 23.0 mt -115.35 126.74 54.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.9 0.381 . . . . 2.77 110.633 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.1 ptt-85 -115.06 128.67 56.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 3.5800000000000001 110.019 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -96.14 132.78 41.19 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.785 -0.643 . . . . 2.3999999999999999 109.65 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.5 mt -118.29 142.58 47.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.027 0.442 . . . . 3.6400000000000001 111.319 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -135.43 107.06 6.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.278 -0.874 . . . . 2.9700000000000002 109.034 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 61.09 34.04 19.26 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.052 0.454 . . . . 3.6400000000000001 111.175 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.57 -19.76 42.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.018 -0.611 . . . . 3.7999999999999998 112.759 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -89.9 133.86 34.53 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.15 -0.315 . . . . 5.0899999999999999 110.15 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.1 ptm85 -77.76 138.4 38.99 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.299 -0.56 . . . . 3.71 110.324 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 42.3 mm -79.27 111.35 16.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.648 -0.706 . . . . 2.5499999999999998 111.267 -179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.29 162.77 22.17 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 3.3799999999999999 109.832 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.88 -30.85 71.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.862 -0.608 . . . . 2.5899999999999999 111.476 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -82.84 4.22 26.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 3.4500000000000002 112.031 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -81.05 164.96 22.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.826 0.346 . . . . 3.6200000000000001 110.841 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 8.9 t -155.77 146.21 16.03 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.438 -0.579 . . . . 2.9900000000000002 109.438 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.56 -17.07 16.0 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.953 2.435 . . . . 2.21 112.927 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -73.32 -15.83 61.38 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.228 -0.442 . . . . 3.3500000000000001 110.787 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 12.5 pt-20 -119.38 171.4 8.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 3.1800000000000002 109.496 178.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 92.2 mt 73.13 -3.23 2.5 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.668 0.605 . . . . 3.2999999999999998 111.153 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.81 47.3 40.58 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 121.033 -0.604 . . . . 2.8799999999999999 113.053 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 10.1 mtt -73.2 131.57 42.16 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.858 -0.423 . . . . 2.7000000000000002 109.858 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 46.1 mt-10 -119.93 178.7 4.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.068 0.461 . . . . 3.4399999999999999 111.606 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -67.92 138.83 56.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.483 -0.78 . . . . 2.3399999999999999 110.535 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 57.59 39.05 27.98 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.593 0.558 . . . . 2.6299999999999999 110.641 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.51 ' O ' ' HG2' ' A' ' 25' ' ' LYS . 1.0 OUTLIER -77.47 164.76 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.015 -0.538 . . . . 2.2799999999999998 110.39 -179.803 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.0 t -103.19 132.86 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.144 0.497 . . . . 2.6699999999999999 111.877 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.646 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -132.98 127.82 55.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.691 -0.855 . . . . 2.0800000000000001 108.691 178.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -103.89 142.14 34.92 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.69 0.281 . . . . 2.8999999999999999 111.036 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.9 p -121.43 126.96 75.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.162 0.506 . . . . 2.3599999999999999 110.206 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -130.72 165.46 22.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.896 -0.593 . . . . 3.0 109.693 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -96.24 139.05 32.95 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.943 0.402 . . . . 3.8100000000000001 110.906 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.92 146.5 39.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.873 -0.603 . . . . 3.6099999999999999 109.584 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -69.42 -25.7 64.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.433 -0.349 . . . . 5.0499999999999998 111.303 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.93 -18.51 62.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.232 -0.44 . . . . 4.6799999999999997 111.437 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.88 -1.27 79.77 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.809 -0.71 . . . . 3.7999999999999998 112.593 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.944 -0.92 . . . . 3.6800000000000002 111.337 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 29.4 tttt . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 110.174 -0.306 . . . . 8.0399999999999991 110.174 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.0 t -80.67 104.02 8.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 N-CA-C 108.935 -0.765 . . . . 3.1899999999999999 108.935 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -119.92 112.81 19.66 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.949 -1.13 . . . . 2.5 107.949 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.659 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 12.2 p -84.74 110.75 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.826 0 CA-C-O 122.062 0.934 . . . . 2.73 110.624 -177.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.434 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 6.4 mt -77.81 117.2 22.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 114.607 -1.179 . . . . 2.1699999999999999 109.859 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.29 106.31 8.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.805 0.336 . . . . 2.5299999999999998 110.909 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.92 11.23 19.1 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.521 0.676 . . . . 2.3199999999999998 109.346 178.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 67.3 p -93.36 8.85 38.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.229 -0.896 . . . . 3.3500000000000001 110.225 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 7.2 tp -61.54 124.74 16.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.459 -0.792 . . . . 4.3600000000000003 111.374 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.5 -30.42 7.14 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.329 -0.85 . . . . 6.2199999999999998 110.019 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 7.2 m -82.97 -178.9 7.28 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.256 -0.883 . . . . 5.8200000000000003 110.776 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -86.56 -27.05 24.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.551 0.215 . . . . 6.3700000000000001 111.435 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.63 107.04 5.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.673 0.273 . . . . 5.9000000000000004 110.855 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.039 -0.528 . . . . 5.6200000000000001 110.877 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 110.005 -0.368 . . . . 3.1299999999999999 110.005 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mm -79.4 142.46 13.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.353 -0.385 . . . . 2.2400000000000002 111.204 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.42 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -121.28 119.27 31.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.343 -0.389 . . . . 3.7000000000000002 110.046 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 87.1 mt -103.51 144.59 31.21 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.221 -0.445 . . . . 1.77 110.0 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 mttp -99.81 103.08 14.68 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.313 -0.403 . . . . 3.1299999999999999 110.625 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 11.0 t -88.03 124.94 41.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.922 -0.581 . . . . 1.76 109.534 179.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 32' ' ' SER . 10.8 mm -119.37 137.41 53.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.014 0.435 . . . . 2.6000000000000001 111.533 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -112.18 172.76 14.96 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.923 -0.58 . . . . 2.6400000000000001 111.969 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 31.6 tp60 -65.52 -20.36 66.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.166 0.507 . . . . 3.73 111.325 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -89.31 18.42 5.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.389 -0.369 . . . . 3.2400000000000002 110.678 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.4 m 59.36 39.93 21.64 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.67 -0.696 . . . . 3.29 111.239 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.45 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 2.0 p -91.01 142.86 27.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.766 -0.652 . . . . 2.5 110.174 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -121.97 114.69 21.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.06 0.457 . . . . 3.0099999999999998 110.063 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.4 mm -126.03 133.55 68.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.979 -0.555 . . . . 2.3199999999999998 110.473 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.532 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 0.2 OUTLIER -91.99 150.2 21.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.061 0.458 . . . . 2.3999999999999999 110.219 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.521 ' CE1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -131.11 108.58 9.85 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.315 -0.402 . . . . 1.9399999999999999 111.832 -178.873 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -81.58 101.51 10.04 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.749 -0.463 . . . . 3.0099999999999998 109.749 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 17.1 m -115.85 166.94 9.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.175 0.512 . . . . 2.0800000000000001 112.287 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' HD3' ' HB2' ' B' ' 10' ' ' GLU . 53.4 tttp -115.04 136.51 53.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.322 -0.854 . . . . 3.6299999999999999 108.987 179.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 43.4 ttp -78.3 85.31 4.44 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.754 0.311 . . . . 3.4100000000000001 110.495 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.45 -44.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.605 -0.725 . . . . 2.5099999999999998 109.853 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 148.17 36.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.683 -0.69 . . . . 2.0 111.266 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -67.17 167.85 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 2.96 110.362 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 78.7 mt -75.29 -3.81 35.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 2.3799999999999999 111.08 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.88 -47.2 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.261 -0.644 . . . . 2.7599999999999998 109.261 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -57.09 -40.1 76.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.272 -0.876 . . . . 2.54 110.73 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -57.03 -39.2 74.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.587 -0.733 . . . . 2.9900000000000002 110.895 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -79.0 -55.33 5.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.8 -0.636 . . . . 2.3900000000000001 112.518 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -44.48 94.91 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.017 0.747 . . . . 1.8799999999999999 113.017 -177.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 63.3 m -62.91 -35.33 79.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.624 0.193 . . . . 1.72 111.229 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -66.9 -45.35 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.577 -0.527 . . . . 1.8899999999999999 109.577 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 59.5 m -62.17 -37.36 84.96 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.823 -0.626 . . . . 1.99 110.342 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -61.32 -44.45 97.18 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.975 -0.557 . . . . 2.1699999999999999 111.13 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.417 ' CZ ' HG12 ' B' ' 5' ' ' ILE . 10.4 ttp180 -76.41 -24.49 54.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.846 0.355 . . . . 2.4900000000000002 110.837 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -75.48 -33.79 60.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.361 -0.382 . . . . 2.4100000000000001 110.266 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.44 32.34 6.7 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.766 -0.652 . . . . 2.7400000000000002 111.851 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.21 152.26 79.83 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 122.928 -0.16 . . . . 2.9399999999999999 110.595 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.47 154.39 74.51 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.646 2.231 . . . . 3.0899999999999999 112.129 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.493 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 11.3 tpt -66.59 145.53 55.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.256 -0.429 . . . . 2.5899999999999999 110.572 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.3 m120 76.54 10.18 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.523 0.729 . . . . 3.7599999999999998 112.344 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.7 p -90.38 -17.71 26.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.297 -0.631 . . . . 3.0800000000000001 109.297 178.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 72.6 mt -124.15 149.13 46.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.362 -0.835 . . . . 2.77 110.092 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.524 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 32.5 ptt-85 -119.2 128.61 54.38 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.042 0.449 . . . . 3.5800000000000001 109.886 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -95.81 132.71 40.77 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.946 -0.57 . . . . 2.3999999999999999 109.841 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.8 mt -112.47 138.59 49.01 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.212 0.529 . . . . 3.6400000000000001 111.307 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -138.41 110.12 7.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 2.9700000000000002 108.51 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 64.52 31.92 12.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.939 -0.573 . . . . 3.6400000000000001 110.873 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.53 -31.53 6.72 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.858 -0.686 . . . . 3.7999999999999998 113.173 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -87.62 161.41 17.71 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.435 -0.209 . . . . 5.0899999999999999 110.435 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -94.04 143.66 26.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.968 0.413 . . . . 3.71 110.584 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 30.4 mm -78.46 121.57 31.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.858 -0.61 . . . . 2.5499999999999998 111.81 -179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -88.74 157.19 18.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 3.3799999999999999 109.891 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -68.9 -22.28 64.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.385 -0.37 . . . . 2.5899999999999999 111.884 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -95.17 8.68 42.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.682 0.277 . . . . 3.4500000000000002 111.625 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -90.79 153.42 20.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.777 0.322 . . . . 3.6200000000000001 110.403 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.6 p -123.18 161.38 45.31 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.236 -0.438 . . . . 2.9900000000000002 111.307 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -68.54 -17.89 43.32 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.685 2.257 . . . . 2.21 111.845 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.1 -42.49 66.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.895 -0.593 . . . . 3.3500000000000001 110.546 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.413 ' HG3' ' HG ' ' A' ' 80' ' ' LEU . 15.1 pt-20 -84.09 176.01 9.1 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.102 -0.499 . . . . 3.1800000000000002 110.243 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.413 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 33.1 mt 73.38 -42.56 0.53 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.502 0.721 . . . . 3.2999999999999998 111.88 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.41 54.29 0.66 Allowed Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.648 -0.581 . . . . 2.8799999999999999 111.648 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.7 ttm -90.47 115.58 27.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.955 0.407 . . . . 2.7000000000000002 110.15 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 34.5 mt-10 -103.53 -178.74 3.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.065 -0.516 . . . . 3.4399999999999999 111.375 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.497 ' HG3' ' HG2' ' A' ' 85' ' ' GLU . 10.1 tp10 -73.4 142.81 46.96 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.109 -0.7 . . . . 2.3399999999999999 109.109 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.497 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 81.2 mm-40 60.32 41.27 16.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.194 0.521 . . . . 2.6299999999999999 109.923 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.4 t0 -85.55 172.46 10.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 2.2799999999999998 110.973 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.4 t -117.92 138.72 47.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.04 0.447 . . . . 2.6699999999999999 111.668 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 10.4 tt -142.54 127.92 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.536 -0.756 . . . . 2.0800000000000001 109.035 178.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -97.95 160.0 14.58 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.896 0.379 . . . . 2.8999999999999999 111.452 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 p -138.1 127.57 33.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.935 -0.575 . . . . 2.3599999999999999 109.916 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -132.85 153.21 51.54 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.455 -0.339 . . . . 3.0 110.392 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -78.48 134.57 37.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.281 -0.418 . . . . 3.8100000000000001 110.91 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.524 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.9 mm-40 -78.01 143.19 37.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.182 -0.463 . . . . 3.6099999999999999 110.026 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -62.35 -23.75 66.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.95 -0.568 . . . . 5.0499999999999998 111.001 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.4 p -71.84 -30.37 65.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.782 -0.645 . . . . 4.6799999999999997 110.763 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.91 15.07 81.66 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.761 -0.654 . . . . 3.7999999999999998 112.233 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.88 0 CA-C-O 119.161 -0.799 . . . . 3.6800000000000002 111.346 -179.858 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 17.1 mtpp . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.746 0.307 . . . . 8.0399999999999991 110.214 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 m -96.68 110.86 25.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 116.191 -0.459 . . . . 3.1899999999999999 110.535 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -73.72 122.13 21.88 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.451 -0.944 . . . . 2.5 108.451 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 1.9 t -93.42 107.0 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-O 120.9 0.381 . . . . 2.73 111.163 -178.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.521 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 16.2 mt -70.91 128.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.077 -0.712 . . . . 2.1699999999999999 109.077 178.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -80.6 105.85 12.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.832 0.348 . . . . 2.5299999999999998 111.147 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.434 HD21 ' CE1' ' A' ' 36' ' ' PHE . 1.3 tp -119.07 18.83 13.08 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.452 -0.944 . . . . 2.3199999999999998 108.452 177.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 58.2 p -74.39 0.45 14.44 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.517 -1.22 . . . . 3.3500000000000001 111.197 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 8.0 mm -80.41 74.88 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.434 0.635 . . . . 4.3600000000000003 110.911 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . 0.594 ' HG3' ' H ' ' B' ' 13' ' ' SER . 12.0 tp10 -74.51 134.09 42.27 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.4 -0.818 . . . . 6.2199999999999998 109.875 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 18.4 m -72.26 -32.7 66.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.492 -0.322 . . . . 5.8200000000000003 111.124 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 2.2 m -69.78 -36.7 75.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.138 0.494 . . . . 6.3700000000000001 110.64 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' SER . . . . . 0.594 ' H ' ' HG3' ' B' ' 10' ' ' GLU . 5.1 m -141.31 101.67 4.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.82 -0.627 . . . . 5.9000000000000004 109.601 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 27.9 t70 . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.191 -0.458 . . . . 5.6200000000000001 110.943 -179.419 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm . . . . . 0 N--CA 1.456 -0.149 0 N-CA-C 110.205 -0.294 . . . . 1.99 110.205 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.0 ttpm? -113.72 120.22 40.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.29 0.567 . . . . 3.07 111.538 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.5 mt -104.18 150.24 24.55 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.139 -0.689 . . . . 1.36 109.139 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -103.93 121.39 43.03 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.92 -0.312 . . . . 2.7 110.878 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.6 t -93.08 121.39 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.904 -0.589 . . . . 1.62 109.988 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.4 mm -103.37 120.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.907 0.384 . . . . 2.39 111.017 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.58 167.87 24.83 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.653 -0.703 . . . . 2.64 111.583 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -77.01 -17.71 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.116 0.484 . . . . 3.73 110.639 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -85.88 20.96 2.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.465 . . . . 3.07 110.364 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 58.96 64.3 1.44 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.596 -0.729 . . . . 3.25 110.91 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -135.76 144.58 45.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.491 -0.777 . . . . 2.47 110.462 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -126.04 94.3 4.06 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.443 -0.577 . . . . 2.99 109.443 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.8 mm -90.5 145.4 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.056 -0.52 . . . . 1.81 110.9 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 32.6 m170 -89.02 132.98 34.5 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.888 -0.782 . . . . 2.04 108.888 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.453 ' CE1' HD12 ' B' ' 7' ' ' LEU . 0.8 OUTLIER -123.16 110.52 15.37 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.817 0.341 . . . . 1.53 110.884 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.574 ' HB2' HG22 ' B' ' 4' ' ' VAL . 24.3 ttmt -81.48 110.65 17.08 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.949 -0.569 . . . . 2.4 110.712 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.7 m -114.13 154.69 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.088 0.47 . . . . 1.57 110.465 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.519 ' HG2' HG22 ' A' ' 41' ' ' THR . 52.6 tttt -106.67 127.27 53.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.378 -0.374 . . . . 3.2 110.143 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.647 ' O ' ' HB ' ' A' ' 41' ' ' THR . 63.1 tpp -74.3 85.88 1.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 3.01 110.565 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.647 ' HB ' ' O ' ' A' ' 40' ' ' MET . 7.4 t 154.31 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.274 1.03 . . . . 2.21 109.055 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.6 m -84.33 134.89 34.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.867 -0.606 . . . . 1.75 110.573 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.15 132.95 54.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.929 -0.578 . . . . 2.43 110.104 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.93 -18.45 60.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 1.89 110.833 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 34.0 tptt -53.9 -47.41 71.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.265 0.555 . . . . 2.44 109.764 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.9 -43.35 83.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.257 -0.883 . . . . 2.08 111.063 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -44.76 96.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.836 0.351 . . . . 2.54 111.077 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -61.25 -52.82 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.041 -0.527 . . . . 2.26 112.354 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.7 pt-20 -63.32 -44.12 95.86 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.422 0.527 . . . . 1.88 112.422 -178.193 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.68 ' HB2' HD13 ' B' ' 7' ' ' LEU . 3.9 m -65.55 -33.44 75.93 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.275 -0.17 . . . . 1.46 111.347 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -69.31 -37.28 77.7 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.574 -0.45 . . . . 1.69 110.012 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 66.7 m -60.95 -39.7 90.48 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.256 -0.646 . . . . 1.99 109.256 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 85.1 mt-30 -63.79 -39.65 94.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.283 -0.872 . . . . 2.17 110.156 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -64.84 -33.62 76.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.055 0.455 . . . . 2.17 109.788 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -70.87 -35.59 72.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.862 -0.608 . . . . 2.41 110.03 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.65 20.63 8.81 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.01 -0.614 . . . . 2.74 112.088 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.7 m -132.62 155.83 80.78 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.438 -0.208 . . . . 2.66 110.438 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.51 164.03 36.75 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.239 1.959 . . . . 2.93 111.217 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 12.3 ttt -71.27 163.04 28.42 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 121.172 -0.211 . . . . 2.52 110.564 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' MET . 16.2 m120 75.7 -0.85 3.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.301 0.64 . . . . 3.65 111.843 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.6 p -85.26 -29.96 24.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.19 0.519 . . . . 2.87 109.809 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.6 mt -119.59 146.13 45.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.472 -0.786 . . . . 2.52 110.594 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -110.8 134.04 52.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.982 -0.554 . . . . 3.47 110.023 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -96.44 120.53 36.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 2.4 109.315 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.5 mt -108.19 130.57 55.13 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.284 0.564 . . . . 3.2 111.572 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -127.46 108.2 10.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.076 -0.965 . . . . 2.97 108.409 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.94 17.46 10.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 3.64 111.013 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.77 -26.65 20.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.085 -0.579 . . . . 3.75 112.285 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -87.03 145.9 26.31 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.87 -0.419 . . . . 4.67 109.87 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -81.42 133.71 35.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.219 0.533 . . . . 3.55 110.383 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.403 HD13 ' HA ' ' A' ' 71' ' ' ILE . 24.0 mm -74.2 113.89 13.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.818 -0.628 . . . . 2.55 110.318 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HB3' ' CD2' ' A' ' 75' ' ' HIS . . . -72.38 155.72 39.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.809 -0.632 . . . . 2.89 110.497 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -65.23 -34.73 79.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.364 0.602 . . . . 2.44 110.434 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -86.99 34.24 0.67 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.523 -0.762 . . . . 3.29 111.977 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.427 ' CD2' ' HB3' ' A' ' 72' ' ' ALA . 17.2 m170 -114.91 159.34 20.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.11 0.481 . . . . 3.27 111.086 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.493 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 3.0 p -133.83 157.69 77.21 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.657 -0.702 . . . . 2.53 109.761 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -64.28 -14.29 43.04 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.412 2.075 . . . . 2.21 112.762 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -68.37 -36.35 79.06 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.217 -0.447 . . . . 2.92 110.673 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.07 177.65 5.91 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.422 -0.584 . . . . 3.18 109.422 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.6 mt 73.62 -47.29 0.65 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 123.652 0.595 . . . . 3.04 110.825 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.71 47.06 0.75 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.091 -0.576 . . . . 2.76 111.858 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.6 mtt -77.85 132.98 38.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.945 0.402 . . . . 2.41 110.62 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 32.3 mt-10 -126.2 177.04 6.64 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.121 -0.491 . . . . 3.44 110.788 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.416 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.7 tp10 -71.87 143.13 49.51 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.088 -0.708 . . . . 2.34 109.088 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 66.64 28.42 9.19 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.504 0.503 . . . . 2.55 110.577 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.2 t0 -74.59 168.92 18.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.032 -0.531 . . . . 2.28 110.403 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.5 t -120.19 124.62 73.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.754 0.311 . . . . 2.19 111.245 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -125.31 133.05 70.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.572 -0.529 . . . . 1.86 109.572 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.11 150.57 23.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.914 0.388 . . . . 2.9 111.217 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -133.96 128.12 52.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.002 -0.545 . . . . 2.36 110.521 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -132.96 162.25 32.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.262 -0.426 . . . . 2.94 110.09 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -89.97 134.88 33.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.021 0.439 . . . . 3.63 110.981 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -72.39 150.26 43.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 3.61 109.624 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -63.14 -35.97 82.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.388 -0.369 . . . . 4.92 111.509 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 p -68.13 -31.63 71.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.859 0.361 . . . . 4.41 111.212 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.57 -10.05 68.92 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.017 -0.611 . . . . 3.73 111.941 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.707 -1.052 . . . . 3.68 111.974 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.574 HG22 ' HB2' ' A' ' 37' ' ' LYS . 12.1 p . . . . . 0 N--CA 1.436 -1.136 0 N-CA-C 108.603 -0.888 . . . . 2.13 108.603 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.472 HG22 ' HG ' ' B' ' 7' ' ' LEU . 3.9 mt -68.86 104.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.701 -0.682 . . . . 1.61 110.33 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -83.16 104.6 13.47 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.836 -0.62 . . . . 2.53 110.486 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' A' ' 50' ' ' SER . 96.7 mt . . . . . 0 C--N 1.317 -0.83 0 CA-C-O 121.238 0.542 . . . . 1.77 109.678 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.9 mm . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.787 0.327 . . . . 1.99 110.736 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.645 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -97.69 123.37 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 3.07 110.678 179.201 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 36' ' ' PHE . 70.8 mt -110.58 118.2 35.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.871 -0.604 . . . . 1.36 109.517 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -80.83 109.32 15.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.905 0.383 . . . . 2.7 110.631 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.1 t -81.02 115.46 23.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.734 -0.666 . . . . 1.62 109.999 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.5 mm -107.3 126.97 63.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.031 -0.531 . . . . 2.39 110.707 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.57 172.32 21.9 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.797 -0.716 . . . . 2.64 111.855 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -64.72 -23.07 67.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.163 0.506 . . . . 3.73 111.113 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.71 15.87 5.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.214 -0.448 . . . . 3.07 110.634 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.5 m 61.92 37.01 15.48 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.958 -0.565 . . . . 3.25 111.036 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -86.39 152.14 22.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.856 -0.611 . . . . 2.47 110.798 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -125.99 115.64 20.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.266 -0.424 . . . . 2.99 110.323 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.422 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 70.4 mt -125.97 139.38 51.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.51 -0.552 . . . . 1.81 109.51 179.211 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.843 ' HB3' HG13 ' B' ' 4' ' ' VAL . 10.5 m170 -88.54 158.44 18.3 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.184 0.516 . . . . 2.04 111.176 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.645 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.05 120.12 12.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.279 -0.419 . . . . 1.53 110.765 -179.365 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.505 ' N ' HG12 ' B' ' 4' ' ' VAL . 5.2 mtmt -100.02 96.87 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.664 0.268 . . . . 2.4 110.376 179.056 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 m -113.8 162.66 11.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.896 0.379 . . . . 1.57 110.945 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.5 tttt -128.28 141.43 51.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.189 -0.46 . . . . 3.2 109.899 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.6 ttm -78.09 84.99 4.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.303 0.573 . . . . 3.01 110.331 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 16.2 m -163.74 -46.32 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.327 -0.852 . . . . 2.21 109.115 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.69 149.07 22.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.296 -0.865 . . . . 1.75 111.507 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -63.93 152.59 39.5 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.27 -0.423 . . . . 2.43 110.42 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.7 mt -67.82 -11.86 59.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.766 0.317 . . . . 1.89 111.177 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -65.85 -30.71 71.37 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.343 -0.614 . . . . 2.44 109.343 178.64 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.436 ' N ' ' HG3' ' A' ' 45' ' ' LYS . 42.4 tptt -68.88 -32.73 72.6 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.5 -0.773 . . . . 2.08 109.074 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' B' ' 7' ' ' LEU . 0.5 OUTLIER -68.81 -41.69 78.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.195 -0.911 . . . . 2.54 110.043 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -64.5 -51.78 61.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.464 -0.789 . . . . 2.26 111.834 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.6 pt-20 -66.29 -43.64 85.75 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.302 0.482 . . . . 1.88 112.302 -178.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.44 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 50.3 m -61.46 -36.58 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 122.4 -0.187 . . . . 1.46 111.384 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -68.88 -38.54 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.822 -0.436 . . . . 1.69 109.822 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 75.4 m -63.13 -42.27 99.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 1.99 109.698 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.44 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.7 mt-30 -64.99 -35.62 81.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.853 -0.612 . . . . 2.17 110.2 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.08 -42.45 80.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.744 -0.662 . . . . 2.17 110.778 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -79.23 -11.81 59.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 2.41 111.332 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.5 31.67 44.93 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.014 -0.612 . . . . 2.74 112.632 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.9 m -121.78 156.53 58.93 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 122.892 -0.181 . . . . 2.66 110.731 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -69.54 159.99 51.45 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.642 2.228 . . . . 2.93 112.103 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.8 145.58 53.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.234 -0.439 . . . . 2.52 111.16 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 71.64 16.81 5.7 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.702 0.801 . . . . 3.65 112.541 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.2 p -92.42 -27.6 17.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.461 0.648 . . . . 2.87 109.611 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.3 mt -111.66 141.75 44.86 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.21 -0.904 . . . . 2.52 110.245 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.467 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 11.4 ptt180 -107.92 118.95 38.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.546 -0.539 . . . . 3.47 109.546 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.04 124.81 35.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.619 -0.719 . . . . 2.4 109.748 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.7 mt -114.34 136.7 52.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.335 0.588 . . . . 3.2 112.052 -178.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.408 ' HB2' HD11 ' A' ' 71' ' ' ILE . 78.7 t80 -129.94 107.47 9.39 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.741 -1.118 . . . . 2.97 108.521 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 61.27 35.23 18.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.979 -0.555 . . . . 3.64 110.982 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.3 -5.42 84.42 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.865 -0.607 . . . . 3.75 113.202 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -104.48 148.0 26.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.152 -0.314 . . . . 4.67 110.152 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 70' ' ' ARG . 12.4 ptm180 -85.94 139.47 31.18 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.43 -0.508 . . . . 3.55 110.476 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 66' ' ' PHE . 37.4 mm -75.27 113.82 14.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.839 -0.619 . . . . 2.55 111.403 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.13 161.42 22.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.161 -0.472 . . . . 2.89 110.047 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.5 -23.82 58.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.252 -0.431 . . . . 2.44 110.971 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -90.56 3.17 54.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.307 -0.406 . . . . 3.29 110.82 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -85.14 147.08 26.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 3.27 110.512 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 40.1 p -126.11 160.93 54.69 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.077 -0.511 . . . . 2.53 110.14 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.37 -7.92 21.54 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.503 2.135 . . . . 2.21 112.023 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -76.23 -31.34 58.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.829 -0.623 . . . . 2.92 110.365 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.4 pt-20 -102.33 -171.01 1.89 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 3.18 110.355 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 62.2 mt 72.72 -36.24 0.35 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.523 0.729 . . . . 3.04 111.924 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 104.65 35.02 3.38 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.944 -0.646 . . . . 2.76 111.856 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.1 mtt -70.12 129.1 38.5 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.913 0.387 . . . . 2.41 111.091 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -126.76 176.27 7.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.054 -0.521 . . . . 3.44 110.17 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -64.23 142.71 58.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.182 -0.463 . . . . 2.34 110.398 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 54.66 50.68 15.36 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.672 0.608 . . . . 2.55 111.221 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.68 -175.61 4.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.418 -0.356 . . . . 2.28 110.366 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.95 138.67 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 2.19 111.407 -178.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.471 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 14.9 tt -137.11 132.27 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.146 -0.687 . . . . 1.86 109.146 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -104.36 146.21 29.15 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.596 0.236 . . . . 2.9 110.663 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p -131.47 129.95 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.046 0.45 . . . . 2.36 110.431 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -134.68 162.79 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.035 -0.53 . . . . 2.94 110.135 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -83.9 135.6 34.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.602 -0.272 . . . . 3.63 110.852 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.467 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 7.1 mm-40 -77.19 146.91 36.75 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.113 -0.328 . . . . 3.61 110.113 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -68.13 -26.0 65.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.868 0.366 . . . . 4.92 110.792 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -35.19 79.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.15 -0.477 . . . . 4.41 111.125 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.11 -37.65 3.37 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.886 -0.673 . . . . 3.73 112.203 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.909 0 CA-C-O 118.7 -1.056 . . . . 3.68 111.762 179.904 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.843 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.664 0.268 . . . . 2.13 110.853 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.419 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 13.7 mt -69.72 115.98 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.479 -0.563 . . . . 1.61 109.479 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 6' ' ' ASP . . . . . 0.462 ' O ' HD23 ' B' ' 7' ' ' LEU . 20.4 m-20 -72.27 106.13 4.32 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 116.665 -0.243 . . . . 2.53 110.948 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.493 ' CD1' ' HA ' ' A' ' 47' ' ' LEU . 11.2 mt . . . . . 0 C--N 1.318 -0.794 0 N-CA-C 109.682 -0.488 . . . . 1.77 109.682 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 84' ' ' GLU . 32.3 mm . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 109.869 -0.419 . . . . 1.99 109.869 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -98.62 119.34 37.18 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.352 -0.385 . . . . 3.07 110.462 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 85.5 mt -101.58 142.18 33.34 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.929 -0.578 . . . . 1.36 110.012 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -97.69 103.08 14.99 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.798 -0.445 . . . . 2.7 109.798 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.9 t -82.37 116.08 25.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.108 -0.497 . . . . 1.62 110.045 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.526 ' HA ' ' O ' ' A' ' 32' ' ' SER . 38.1 mm -108.16 123.25 63.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.928 -0.578 . . . . 2.39 111.159 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.72 177.93 32.09 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.73 -0.748 . . . . 2.64 111.591 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -69.0 -20.47 64.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.237 0.542 . . . . 3.73 110.471 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -86.18 11.7 11.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.58 -0.736 . . . . 3.07 110.343 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.1 m 62.0 34.11 16.87 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.394 -0.821 . . . . 3.25 111.968 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 29.1 p -92.57 150.19 20.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.318 -0.623 . . . . 2.47 109.318 178.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -124.36 112.77 17.35 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.977 -0.379 . . . . 2.99 109.977 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 15.8 mm -111.96 142.78 23.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.791 -0.448 . . . . 1.81 109.791 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.528 ' HB3' HG13 ' B' ' 4' ' ' VAL . 10.9 m-70 -91.35 140.26 29.94 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.923 0.392 . . . . 2.04 110.17 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.589 ' HE1' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -131.67 121.69 24.7 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.332 0.493 . . . . 1.53 112.332 -178.385 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.49 ' HE3' ' HB ' ' B' ' 4' ' ' VAL . 32.0 mttt -81.39 99.46 8.71 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.557 -0.292 . . . . 2.4 110.474 177.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.7 p -115.53 163.7 12.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.983 0.42 . . . . 1.57 111.06 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.32 144.06 46.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.419 -0.355 . . . . 3.2 110.154 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.6 84.67 7.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.223 0.535 . . . . 3.01 109.744 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -166.8 -60.31 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.653 -0.869 . . . . 2.21 108.653 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.7 m -76.45 148.46 37.24 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.919 -1.037 . . . . 1.75 110.304 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.437 ' HA ' HG22 ' A' ' 76' ' ' THR . 12.8 m-70 -62.12 156.73 20.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.001 0.429 . . . . 2.43 111.145 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.09 -5.41 35.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.038 -0.528 . . . . 1.89 110.588 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -61.9 -42.91 99.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.496 -0.774 . . . . 2.44 109.182 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -61.94 -39.3 91.63 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.584 -0.735 . . . . 2.08 109.628 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.441 HD22 ' HA ' ' A' ' 47' ' ' LEU . 0.9 OUTLIER -59.65 -38.39 81.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.293 -0.867 . . . . 2.54 110.184 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -73.05 -52.63 13.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.71 . . . . 2.26 112.512 -178.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.488 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 10.0 pt-20 -67.66 -44.31 78.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.936 0.717 . . . . 1.88 112.936 -177.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.436 ' HB3' HD11 ' B' ' 7' ' ' LEU . 15.0 m -59.16 -34.94 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.794 0.331 . . . . 1.46 111.172 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.402 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 27.9 t80 -66.38 -44.1 84.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.048 0.451 . . . . 1.69 109.818 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 58.0 m -61.66 -33.92 74.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.425 -0.807 . . . . 1.99 110.79 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 97.5 mt-30 -63.31 -40.37 97.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 2.17 110.975 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 -74.07 -33.53 63.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 2.17 110.619 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 12.4 mm100 -79.79 -8.34 59.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.993 0.425 . . . . 2.41 110.77 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.79 36.06 66.23 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.998 -0.546 . . . . 2.74 113.14 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.408 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 8.0 m -131.88 149.85 74.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 O-C-N 122.621 -0.34 . . . . 2.66 110.698 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -65.84 156.57 63.51 Favored 'Trans proline' 0 N--CA 1.464 -0.206 0 C-N-CA 122.493 2.129 . . . . 2.93 111.626 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.509 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 20.3 ttt -69.82 152.98 43.94 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 121.109 -0.236 . . . . 2.52 110.426 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.9 m120 78.96 -0.19 2.39 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.618 0.767 . . . . 3.65 112.076 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.3 p -83.68 -24.67 31.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.65 0.738 . . . . 2.87 109.131 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -120.61 145.39 47.43 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.911 -1.04 . . . . 2.52 109.836 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HD2' HD11 ' A' ' 65' ' ' LEU . 22.7 ptt-85 -112.33 138.82 48.5 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.043 -0.526 . . . . 3.47 109.787 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.431 ' HB3' HD11 ' A' ' 88' ' ' ILE . 49.2 m-85 -107.0 128.26 54.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.482 -0.562 . . . . 2.4 109.482 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.411 HD11 ' HD2' ' A' ' 63' ' ' ARG . 6.7 mp -116.14 134.42 54.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.226 0.536 . . . . 3.2 112.05 -178.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.403 ' HE1' ' OD1' ' A' ' 86' ' ' ASP . 65.2 t80 -129.63 115.56 17.56 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.354 -0.839 . . . . 2.97 109.016 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.39 26.32 15.71 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.818 -0.628 . . . . 3.64 111.391 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.64 -20.73 49.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.985 -0.626 . . . . 3.75 113.426 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -99.79 138.68 36.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.955 0.377 . . . . 4.67 110.631 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -75.46 135.85 40.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.331 0.586 . . . . 3.55 110.469 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 36.9 mm -71.05 126.44 31.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.327 -0.851 . . . . 2.55 111.86 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.435 ' HB3' ' CD2' ' A' ' 75' ' ' HIS . . . -91.98 162.59 14.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.668 -0.696 . . . . 2.89 109.729 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -72.92 -24.96 60.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.85 0.357 . . . . 2.44 111.406 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -87.95 3.61 48.0 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.86 0.362 . . . . 3.29 110.755 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.435 ' CD2' ' HB3' ' A' ' 72' ' ' ALA . 13.9 m170 -86.48 152.21 22.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.008 0.432 . . . . 3.27 111.013 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 20.6 p -129.97 161.77 57.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.612 -0.722 . . . . 2.53 109.8 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -69.13 -13.22 35.86 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.389 2.059 . . . . 2.21 111.765 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -74.0 -34.6 64.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.764 -0.653 . . . . 2.92 110.418 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.3 pt-20 -91.84 175.88 6.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.43 -0.581 . . . . 3.18 109.43 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.422 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 24.1 mt 72.04 -29.96 0.2 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.091 0.556 . . . . 3.04 111.845 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 95.64 36.82 5.21 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.977 -0.63 . . . . 2.76 112.181 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 50.2 mtp -73.68 131.24 41.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.765 -0.457 . . . . 2.41 109.765 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -125.37 -169.06 1.93 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.741 0.305 . . . . 3.44 111.32 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 22' ' ' ILE . 9.9 tp10 -71.06 142.83 50.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.986 -0.552 . . . . 2.34 110.606 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 59.8 32.25 21.23 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 123.548 0.53 . . . . 2.55 111.223 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.403 ' OD1' ' HE1' ' A' ' 66' ' ' PHE . 1.1 t0 -76.53 171.01 15.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 2.28 110.628 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.6 t -118.08 140.34 41.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.084 0.469 . . . . 2.19 111.707 -178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.1 tt -139.0 127.64 28.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.149 -0.686 . . . . 1.86 109.149 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.418 ' O ' ' HA ' ' A' ' 64' ' ' PHE . 44.5 mt-10 -94.8 149.29 21.4 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.651 0.263 . . . . 2.9 111.564 -178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -130.5 125.66 59.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.131 -0.486 . . . . 2.36 110.241 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -132.56 161.54 33.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.308 -0.405 . . . . 2.94 110.515 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -86.92 130.93 34.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.806 0.336 . . . . 3.63 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.73 140.16 42.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.488 -0.324 . . . . 3.61 110.17 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -56.56 -36.28 69.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.945 -0.57 . . . . 4.92 111.156 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.34 -29.54 70.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.114 -0.494 . . . . 4.41 111.847 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.09 -1.04 86.43 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.06 -0.591 . . . . 3.73 112.586 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.692 -1.06 . . . . 3.68 111.833 179.89 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 35' ' ' HIS . 1.6 t . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 109.759 -0.459 . . . . 2.13 109.759 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.536 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 21.4 mt -68.64 118.47 12.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.725 -0.472 . . . . 1.61 109.725 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -76.51 121.34 22.99 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.871 -0.604 . . . . 2.53 111.31 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.589 HD13 ' HE1' ' A' ' 36' ' ' PHE . 2.2 mp . . . . . 0 C--N 1.32 -0.699 0 CA-C-O 121.506 0.67 . . . . 1.77 109.4 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.9 mm . . . . . 0 CA--C 1.523 -0.079 0 CA-C-O 121.059 0.457 . . . . 1.99 111.574 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 4.3 ttpm? -110.45 118.79 37.2 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.083 -0.508 . . . . 3.07 109.726 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -101.52 150.41 23.09 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.92 -0.582 . . . . 1.36 110.641 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.546 ' HE3' ' NE2' ' A' ' 35' ' ' HIS . 31.9 mtpt -103.42 110.48 22.51 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.411 -0.589 . . . . 2.7 109.411 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.1 t -88.46 125.13 41.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.262 -0.426 . . . . 1.62 110.517 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 32' ' ' SER . 35.2 mm -113.31 123.88 69.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.935 -0.575 . . . . 2.39 110.625 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.38 177.53 40.95 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.937 -0.649 . . . . 2.64 111.874 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -69.5 -27.76 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.571 0.185 . . . . 3.73 111.31 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -88.7 26.5 1.49 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.752 0.31 . . . . 3.07 110.954 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m 61.64 34.77 17.45 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.316 0.579 . . . . 3.25 110.793 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.544 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -84.45 149.02 26.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.764 -0.653 . . . . 2.47 110.343 -179.714 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -131.43 120.04 22.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.183 -0.462 . . . . 2.99 110.192 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.8 mm -131.55 139.47 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.359 -0.608 . . . . 1.81 109.359 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.565 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 20.2 m170 -89.49 140.22 29.75 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.473 -0.566 . . . . 2.04 109.473 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.56 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -127.93 106.55 9.17 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.537 -0.301 . . . . 1.53 111.091 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.441 ' HB2' HG22 ' B' ' 4' ' ' VAL . 5.5 ttmt -79.26 103.49 9.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.116 -0.493 . . . . 2.4 109.714 178.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 m -109.38 159.65 8.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.043 0.449 . . . . 1.57 111.215 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -104.58 126.28 51.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.058 -0.519 . . . . 3.2 109.94 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 57.2 ttp -76.57 84.71 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.102 -0.703 . . . . 3.01 109.102 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.3 m 168.52 -36.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.21 108.132 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.5 m -76.26 145.56 39.59 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.168 -0.924 . . . . 1.75 110.603 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -69.76 148.52 49.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.398 -0.365 . . . . 2.43 110.723 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.654 ' HA ' HD23 ' A' ' 47' ' ' LEU . 97.1 mt -66.36 -15.07 62.99 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 1.89 111.329 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 8.6 tptt -60.03 -39.55 86.26 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.528 -0.545 . . . . 2.44 109.528 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -61.45 -42.62 99.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.195 -0.911 . . . . 2.08 110.683 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 44' ' ' LEU . 1.8 mm? -66.49 -40.9 89.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.947 -0.569 . . . . 2.54 110.49 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -64.15 -51.07 65.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 2.26 112.251 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -63.08 -47.69 81.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.269 0.47 . . . . 1.88 112.269 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.584 ' CB ' HD21 ' B' ' 7' ' ' LEU . 67.9 m -65.13 -32.48 74.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.818 0.303 . . . . 1.46 111.818 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.06 -40.21 90.71 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.018 -0.734 . . . . 1.69 109.018 179.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 74.4 m -64.39 -38.05 89.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.647 -0.706 . . . . 1.99 109.493 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.523 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 91.1 mt-30 -64.12 -41.39 97.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.772 -0.649 . . . . 2.17 110.281 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.44 ' NH1' HG12 ' B' ' 5' ' ' ILE . 26.9 ttt180 -67.65 -38.76 84.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.463 -0.335 . . . . 2.17 111.012 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -79.58 -9.92 59.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.53 -0.305 . . . . 2.41 111.293 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.09 36.97 56.23 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 121.111 -0.566 . . . . 2.74 112.496 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.74 151.55 71.03 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 110.482 -0.192 . . . . 2.66 110.482 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -67.07 157.91 59.44 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.844 2.363 . . . . 2.93 111.729 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.471 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 16.3 tpt -64.13 143.31 57.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.543 -0.299 . . . . 2.52 111.055 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 59' ' ' MET . 5.0 m120 75.48 1.4 3.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.057 0.762 . . . . 3.65 113.057 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.4 p -74.71 -26.48 59.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.238 0.542 . . . . 2.87 109.683 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 44.6 mt -119.11 150.11 40.56 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.386 -0.825 . . . . 2.52 110.148 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.0 ptt-85 -113.06 142.13 46.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.005 -0.543 . . . . 3.47 109.658 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.402 ' HB3' HD11 ' A' ' 88' ' ' ILE . 80.6 m-85 -108.48 114.4 28.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.214 -0.448 . . . . 2.4 109.805 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.6 mt -106.39 123.58 48.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.116 0.484 . . . . 3.2 111.406 -178.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -124.5 111.43 15.69 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.679 -0.691 . . . . 2.97 109.281 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 61.86 24.56 14.64 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.094 -0.503 . . . . 3.64 111.347 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.68 73.56 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.551 -0.833 . . . . 3.75 112.401 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -105.41 134.13 49.03 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.786 -0.449 . . . . 4.67 109.786 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.09 131.2 37.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.325 0.584 . . . . 3.55 110.025 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.2 mm -68.24 111.47 2.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.536 -0.756 . . . . 2.55 111.356 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.51 157.11 24.95 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.144 -0.48 . . . . 2.89 110.348 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.415 ' CG ' ' HD3' ' A' ' 45' ' ' LYS . 85.3 m-20 -67.24 -26.34 66.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.114 -0.494 . . . . 2.44 111.491 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -93.73 11.81 27.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.348 -0.387 . . . . 3.29 111.46 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.432 ' HB3' HD12 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -91.49 157.02 17.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.123 0.487 . . . . 3.27 110.832 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.576 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -137.48 157.76 73.32 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 2.53 110.256 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.91 -19.35 61.99 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.696 2.264 . . . . 2.21 112.636 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -64.63 -35.94 82.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.905 0.383 . . . . 2.92 110.888 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.5 pt-20 -94.99 176.88 6.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 3.18 110.295 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 81.3 mt 70.13 -9.37 0.74 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.071 0.548 . . . . 3.04 111.906 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 71.1 44.42 54.25 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.923 -0.656 . . . . 2.76 111.99 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -70.56 138.62 51.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.505 0.193 . . . . 2.41 110.628 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.527 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 42.0 mt-10 -127.42 170.12 12.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.797 0.332 . . . . 3.44 110.619 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 20.8 tp10 -69.47 140.9 54.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.912 -0.586 . . . . 2.34 109.473 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 31.5 mm-40 70.11 19.87 6.59 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.526 0.516 . . . . 2.55 111.261 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.7 OUTLIER -73.82 160.94 30.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.975 -0.38 . . . . 2.28 109.975 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 82.5 t -108.44 131.35 59.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.045 0.45 . . . . 2.19 111.99 -178.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' A' ' 64' ' ' PHE . 17.2 tt -126.0 131.69 71.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.669 -0.863 . . . . 1.86 108.669 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -102.88 137.54 40.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.813 0.339 . . . . 2.9 111.7 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 5.4 p -121.2 126.61 75.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 2.36 110.295 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -132.64 160.87 35.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.638 0.256 . . . . 2.94 111.081 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -81.07 135.53 35.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.264 -0.425 . . . . 3.63 110.948 -179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -84.08 148.11 27.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.229 -0.441 . . . . 3.61 109.952 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -66.94 -25.92 66.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.423 -0.353 . . . . 4.92 111.655 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.27 -33.19 65.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.713 0.292 . . . . 4.41 111.455 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.79 5.73 87.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.766 -0.73 . . . . 3.73 112.024 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.868 0 CA-C-O 118.875 -0.958 . . . . 3.68 111.91 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 10.4 p . . . . . 0 N--CA 1.446 -0.659 0 CA-C-O 121.279 0.561 . . . . 2.13 110.382 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.56 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 5.7 mt -76.38 119.36 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 109.426 -0.583 . . . . 1.61 109.426 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -83.54 105.93 14.86 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 120.676 0.274 . . . . 2.53 110.617 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.584 HD21 ' CB ' ' A' ' 50' ' ' SER . 0.4 OUTLIER . . . . . 0 C--N 1.315 -0.897 0 CA-C-O 121.138 0.494 . . . . 1.77 110.657 179.003 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.1 mm . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 109.428 -0.582 . . . . 1.99 109.428 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -93.47 118.66 31.6 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.063 0.459 . . . . 3.07 110.938 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 94.0 mt -104.49 150.61 24.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.717 -0.674 . . . . 1.36 109.691 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -113.65 113.22 24.73 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.031 0.443 . . . . 2.7 111.592 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.439 HG22 ' CG2' ' A' ' 88' ' ' ILE . 60.4 t -96.44 119.37 44.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.22 -0.659 . . . . 1.62 109.22 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.524 ' HA ' ' O ' ' A' ' 32' ' ' SER . 25.1 mm -100.62 120.39 50.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 2.39 111.555 -178.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.61 171.0 42.92 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.263 -0.735 . . . . 2.64 111.263 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.5 tp60 -69.58 -22.82 63.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.126 0.489 . . . . 3.73 110.867 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -85.85 15.26 5.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.977 -0.556 . . . . 3.07 110.995 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 65.51 47.31 2.28 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.231 0.539 . . . . 3.25 111.43 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.524 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 13.3 p -111.6 136.06 51.33 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.351 -0.611 . . . . 2.47 109.351 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -115.6 94.96 4.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.992 0.425 . . . . 2.99 110.559 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.5 mt -91.07 138.56 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.166 -0.47 . . . . 1.81 110.235 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.649 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 33.4 m80 -92.12 138.74 31.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.88 -0.6 . . . . 2.04 111.775 -178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.421 ' HZ ' ' CD1' ' A' ' 51' ' ' TYR . 4.4 m-85 -126.17 106.69 9.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.795 -0.639 . . . . 1.53 109.995 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.597 ' HE2' HG21 ' B' ' 4' ' ' VAL . 23.9 mtmt -85.29 96.84 9.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.217 0.532 . . . . 2.4 110.89 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.8 m -106.58 171.2 2.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.761 -0.654 . . . . 1.57 110.785 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -128.06 141.17 51.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.32 -0.622 . . . . 3.2 109.32 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 ttp -77.64 84.9 3.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.387 0.613 . . . . 3.01 109.789 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 48.3 m -164.88 -51.59 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.92 -1.036 . . . . 2.21 108.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.34 148.61 32.01 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.825 -1.079 . . . . 1.75 110.313 179.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -67.4 159.16 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.258 -0.428 . . . . 2.43 110.616 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.9 mt -69.29 -11.88 61.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.249 0.547 . . . . 1.89 109.71 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.46 72.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.198 -0.91 . . . . 2.44 109.216 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.5 tptt -60.31 -43.42 96.34 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.102 -0.954 . . . . 2.08 110.928 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.471 ' HA ' HD13 ' B' ' 7' ' ' LEU . 3.8 tt -64.8 -33.48 76.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.063 0.458 . . . . 2.54 111.044 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -74.45 -36.7 63.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 2.26 112.002 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 0.1 OUTLIER -82.24 -45.82 14.53 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.61 0.596 . . . . 1.88 112.61 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 p -58.8 -45.53 89.66 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.328 0.492 . . . . 1.46 112.328 -178.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.421 ' CD1' ' HZ ' ' A' ' 36' ' ' PHE . 6.9 t80 -64.33 -36.2 83.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.72 -0.392 . . . . 1.69 111.39 -179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.7 m -61.22 -39.42 90.19 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.091 0.472 . . . . 1.99 109.948 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -63.88 -44.28 93.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.744 . . . . 2.17 110.391 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.72 -42.21 91.34 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.973 -0.558 . . . . 2.17 110.837 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -69.2 -26.86 65.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.506 -0.315 . . . . 2.41 110.903 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.61 33.18 10.4 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.8 -0.714 . . . . 2.74 111.84 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 m -133.01 154.3 81.3 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.745 0.307 . . . . 2.66 110.5 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.69 149.86 73.82 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.56 2.173 . . . . 2.93 111.722 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.525 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 23.1 ttt -68.64 161.66 27.65 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.504 -0.317 . . . . 2.52 110.242 179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 59' ' ' MET . 11.3 m120 78.53 -12.09 1.13 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.512 0.725 . . . . 3.65 111.589 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -78.3 -31.24 48.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.341 0.591 . . . . 2.87 109.515 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -108.84 131.66 54.77 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.438 -0.801 . . . . 2.52 110.1 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptt-85 -107.99 122.92 47.84 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 3.47 110.086 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -88.3 125.11 34.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.964 -0.562 . . . . 2.4 109.696 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.4 mt -110.06 131.64 54.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.986 -0.552 . . . . 3.2 110.862 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -124.81 106.34 9.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.621 -0.718 . . . . 2.97 109.291 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 64.35 33.2 11.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 3.64 111.054 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.83 -21.07 45.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.815 -0.707 . . . . 3.75 113.895 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -103.2 138.71 39.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.263 0.531 . . . . 4.67 110.565 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -70.47 148.42 48.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.297 0.57 . . . . 3.55 111.061 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 29.5 mm -85.22 120.88 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.427 -0.806 . . . . 2.55 111.533 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.87 156.52 24.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.962 -0.563 . . . . 2.89 109.913 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -70.08 -27.03 64.29 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.267 -0.424 . . . . 2.44 111.598 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -87.63 1.23 54.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.309 -0.405 . . . . 3.29 111.234 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.7 m170 -85.16 144.92 27.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.045 0.45 . . . . 3.27 110.858 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.483 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 41.8 p -120.99 161.63 39.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.709 -0.678 . . . . 2.53 109.926 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.81 -3.08 7.5 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.666 2.244 . . . . 2.21 112.479 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -79.64 -35.5 39.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.955 -0.566 . . . . 2.92 110.37 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 76' ' ' THR . 2.9 pt-20 -94.54 -179.57 4.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.185 -0.462 . . . . 3.18 109.992 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.6 mt 73.05 -29.54 0.2 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.327 0.651 . . . . 3.04 111.776 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 94.06 34.58 6.4 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.363 -0.695 . . . . 2.76 111.363 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.2 ttm -65.7 128.76 37.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 2.41 110.974 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -121.46 -177.65 3.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.987 -0.551 . . . . 3.44 110.635 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -75.59 144.52 41.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.149 -0.478 . . . . 2.34 110.275 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 62.1 27.05 16.31 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.582 0.551 . . . . 2.55 110.584 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.68 140.64 40.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.544 . . . . 2.28 110.602 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.403 HG13 HG12 ' A' ' 27' ' ' ILE . 54.8 t -90.38 127.28 42.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.708 -0.678 . . . . 2.19 111.631 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.439 ' CG2' HG22 ' A' ' 26' ' ' VAL . 19.3 tt -125.68 139.97 49.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.61 -0.885 . . . . 1.86 108.61 178.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -104.86 157.99 16.83 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.992 0.425 . . . . 2.9 111.444 -178.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 p -141.19 121.91 12.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 2.36 110.418 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -128.55 161.7 28.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.029 -0.532 . . . . 2.94 109.711 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -92.42 138.41 31.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 3.63 110.955 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -72.36 142.67 48.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.892 -0.595 . . . . 3.61 110.019 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -66.98 -34.41 77.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.393 -0.367 . . . . 4.92 110.597 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -35.52 80.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.019 -0.537 . . . . 4.41 111.408 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.24 -27.68 15.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.842 -0.694 . . . . 3.73 111.902 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.874 0 CA-C-O 118.88 -0.955 . . . . 3.68 111.749 179.745 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.649 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 7.4 p . . . . . 0 N--CA 1.441 -0.89 0 N-CA-C 109.278 -0.638 . . . . 2.13 109.278 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -90.58 109.61 21.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.829 -0.623 . . . . 1.61 110.757 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' ASP . . . . . 0.41 ' HA ' ' O ' ' A' ' 37' ' ' LYS . 1.8 m-20 -76.46 117.95 18.64 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 116.058 -0.519 . . . . 2.53 109.757 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 47' ' ' LEU . 13.1 mt . . . . . 0 C--N 1.313 -0.997 0 CA-C-O 121.45 0.643 . . . . 1.77 110.033 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.3 mm . . . . . 0 CA--C 1.52 -0.204 0 N-CA-C 110.118 -0.327 . . . . 1.99 110.118 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 tttt -103.39 119.76 39.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.164 0.507 . . . . 3.07 111.364 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.0 mt -106.33 150.25 26.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.561 -0.745 . . . . 1.36 109.537 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -104.74 106.57 17.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.432 -0.349 . . . . 2.7 110.581 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.01 123.02 37.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.202 -0.666 . . . . 1.62 109.202 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 89' ' ' GLU . 48.1 mm -117.92 108.57 24.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.013 0.435 . . . . 2.39 110.625 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.28 170.13 50.42 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.582 -0.818 . . . . 2.64 111.29 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -64.99 -27.69 69.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.14 0.495 . . . . 3.73 110.731 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.15 25.41 1.87 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.686 -0.688 . . . . 3.07 111.411 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.8 m 60.11 33.84 21.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.167 0.508 . . . . 3.25 111.839 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.42 114.11 23.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.991 -0.55 . . . . 2.47 109.739 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -101.37 108.75 20.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.609 -0.515 . . . . 2.99 109.609 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.8 mm -115.66 144.43 23.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.567 0.223 . . . . 1.81 110.41 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -89.06 141.78 28.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.916 0.389 . . . . 2.04 110.391 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.491 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -133.79 104.41 6.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 1.53 111.063 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.404 ' CE ' HG11 ' B' ' 4' ' ' VAL . 4.7 mtmt -91.01 106.75 18.74 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.254 0.55 . . . . 2.4 110.982 178.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.45 HG11 HD23 ' A' ' 47' ' ' LEU . 18.0 m -111.83 170.46 3.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.689 -0.687 . . . . 1.57 111.249 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.483 ' HE2' ' OG1' ' A' ' 42' ' ' THR . 16.1 pttm -119.16 138.67 52.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.989 -0.55 . . . . 3.2 109.922 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 42.7 tpp -75.1 84.71 2.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.125 0.488 . . . . 3.01 110.141 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.3 -55.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 2.21 109.369 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.483 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 0.8 OUTLIER -79.09 147.64 32.7 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.126 -0.943 . . . . 1.75 110.841 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -70.19 173.51 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.236 -0.653 . . . . 2.43 109.236 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.01 3.89 6.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.246 0.546 . . . . 1.89 110.139 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.4 tptt -60.24 -46.2 90.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.102 -0.953 . . . . 2.44 109.208 177.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -65.24 -38.48 90.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.888 -1.051 . . . . 2.08 110.037 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.45 HD23 HG11 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -53.93 -46.15 71.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.815 -0.63 . . . . 2.54 110.581 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 53.7 mtpt -70.05 -54.67 12.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.725 -0.67 . . . . 2.26 112.647 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -43.62 79.79 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.198 0.814 . . . . 1.88 113.198 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.8 m -63.47 -37.1 86.0 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.327 -0.233 . . . . 1.46 111.537 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -67.17 -43.68 81.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.636 -0.426 . . . . 1.69 109.915 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.66 -37.65 82.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.01 0.433 . . . . 1.99 110.303 179.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -60.39 -43.08 96.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.825 -0.625 . . . . 2.17 110.518 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.18 -28.78 61.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.326 -0.397 . . . . 2.17 110.888 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -74.92 -19.68 60.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.511 -0.313 . . . . 2.41 111.184 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.64 25.38 42.5 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.609 -0.805 . . . . 2.74 112.288 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 7.0 m -127.73 154.7 77.91 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 110.07 -0.345 . . . . 2.66 110.07 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.38 161.91 44.28 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.283 1.988 . . . . 2.93 111.771 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.06 153.36 43.9 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.292 -0.413 . . . . 2.52 110.664 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t30 74.96 5.97 4.32 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.612 0.765 . . . . 3.65 112.069 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.5 p -88.81 -26.01 21.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.263 0.554 . . . . 2.87 109.698 178.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -115.5 146.22 41.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.47 -0.786 . . . . 2.52 110.24 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.5 ptt-85 -119.0 133.99 55.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.401 -0.592 . . . . 3.47 109.401 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 96.2 m-85 -102.65 128.05 49.5 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.069 -0.514 . . . . 2.4 109.906 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.9 mt -110.35 133.45 53.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.378 0.609 . . . . 3.2 111.546 -179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -124.95 105.55 9.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.106 -0.952 . . . . 2.97 108.508 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 63.95 22.68 13.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.862 -0.608 . . . . 3.64 110.87 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.17 -25.75 26.13 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.973 -0.632 . . . . 3.75 112.678 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -87.36 143.07 27.43 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.099 -0.334 . . . . 4.67 110.099 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -82.16 140.33 33.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.257 0.551 . . . . 3.55 110.706 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.6 mm -78.56 116.14 21.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.559 -0.746 . . . . 2.55 111.082 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.57 26.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.016 -0.538 . . . . 2.89 110.39 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.426 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.1 m-20 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.227 -0.442 . . . . 2.44 111.222 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -92.21 -2.52 56.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.498 -0.319 . . . . 3.29 111.68 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.2 m170 -67.35 143.89 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.765 0.317 . . . . 3.27 110.877 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 75.6 p -120.27 155.84 55.67 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 116.307 -0.406 . . . . 2.53 110.615 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.01 -11.05 28.69 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.39 2.06 . . . . 2.21 111.212 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -78.89 -38.92 36.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.504 -0.771 . . . . 2.92 110.274 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 10.0 pt-20 -86.49 -179.15 6.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.462 -0.335 . . . . 3.18 110.41 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 9.0 mt 72.07 -54.75 0.68 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.225 0.61 . . . . 3.04 111.674 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.85 36.36 0.67 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.673 -0.571 . . . . 2.76 111.673 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.07 132.37 45.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.9 0.381 . . . . 2.41 110.453 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -124.79 -168.74 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.12 0.486 . . . . 3.44 111.485 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -76.24 143.76 40.79 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.518 -0.764 . . . . 2.34 109.681 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 60.59 28.12 17.81 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.421 . . . . 2.55 110.893 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.92 147.15 43.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 2.28 110.153 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 17.6 t -96.09 128.32 47.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.234 0.54 . . . . 2.19 111.708 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.8 tt -125.57 112.81 32.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.742 -0.836 . . . . 1.86 108.742 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 27' ' ' ILE . 75.8 mt-10 -88.64 141.45 28.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.736 -0.666 . . . . 2.9 111.181 -178.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.41 137.52 53.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.075 -0.511 . . . . 2.36 110.349 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -137.12 163.36 31.01 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.557 -0.534 . . . . 2.94 109.557 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -95.81 139.43 32.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.686 0.279 . . . . 3.63 110.48 -179.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -79.17 149.34 32.01 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 3.61 110.289 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -58.59 -45.5 88.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 4.92 110.841 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.7 p -72.05 -32.75 67.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.056 -0.52 . . . . 4.41 110.277 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.73 15.04 70.78 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.682 -0.69 . . . . 3.73 112.296 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.936 0 N-CA-C 110.922 -0.871 . . . . 3.68 110.922 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.404 HG11 ' CE ' ' A' ' 37' ' ' LYS . 15.0 p . . . . . 0 N--CA 1.443 -0.776 0 CA-C-O 121.433 0.635 . . . . 2.13 110.94 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.491 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 18.4 mt -87.55 108.52 18.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.828 -0.624 . . . . 1.61 109.502 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 6' ' ' ASP . . . . . 0.422 ' O ' HD23 ' B' ' 7' ' ' LEU . 22.8 m-20 -79.67 134.42 36.42 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.79 -0.448 . . . . 2.53 109.79 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.422 HD23 ' O ' ' B' ' 6' ' ' ASP . 18.2 mt . . . . . 0 C--N 1.32 -0.68 0 CA-C-O 121.479 0.657 . . . . 1.77 109.989 178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.9 mm . . . . . 0 N--CA 1.456 -0.171 0 N-CA-C 109.994 -0.373 . . . . 1.99 109.994 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 35.6 ttpt -112.43 118.59 35.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.442 -0.345 . . . . 3.07 110.204 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.3 mt -102.67 150.29 23.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.334 -0.394 . . . . 1.36 110.039 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -107.82 111.45 23.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.782 0.325 . . . . 2.7 111.173 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 20.2 t -90.06 104.35 15.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.129 -0.693 . . . . 1.62 109.129 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.76 114.93 30.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.066 0.46 . . . . 2.39 111.47 -178.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 170.05 34.56 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.771 -0.65 . . . . 2.64 111.949 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -71.85 -16.59 62.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.135 0.493 . . . . 3.73 110.9 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -91.69 15.03 13.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.486 . . . . 3.07 110.747 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.9 m 68.14 30.17 5.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.582 -0.735 . . . . 3.25 111.708 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 55.7 p -99.18 140.69 32.96 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.494 -0.558 . . . . 2.47 109.494 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.429 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 5.0 pt-20 -125.71 92.57 3.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.133 0.492 . . . . 2.99 110.939 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 6.6 mm -81.22 139.3 18.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.767 -0.827 . . . . 1.81 108.767 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.414 ' HB3' HG13 ' B' ' 4' ' ' VAL . 2.2 m-70 -95.64 147.61 23.4 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.871 -0.332 . . . . 2.04 110.32 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.602 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -125.62 117.11 22.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.324 -0.398 . . . . 1.53 111.164 -179.32 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.46 ' N ' HG12 ' B' ' 4' ' ' VAL . 3.6 mtmt -96.68 96.11 8.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.136 0.493 . . . . 2.4 110.818 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.447 HG12 ' HB2' ' B' ' 7' ' ' LEU . 16.2 m -118.29 170.88 7.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.733 . . . . 1.57 111.35 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.89 147.0 50.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.932 -0.766 . . . . 3.2 108.932 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.654 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 23.1 mmt -69.39 86.2 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.209 0.528 . . . . 3.01 110.672 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.1 m -164.53 -52.32 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.529 -0.76 . . . . 2.21 109.622 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.05 147.66 34.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.261 -0.881 . . . . 1.75 111.484 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -69.37 165.58 20.46 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.154 -0.475 . . . . 2.43 110.586 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.483 HD13 HD12 ' A' ' 71' ' ' ILE . 53.2 mt -70.99 -9.92 58.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.149 0.499 . . . . 1.89 110.564 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG3' ' OD2' ' A' ' 73' ' ' ASP . 40.3 tttp -63.49 -38.01 89.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.236 -0.653 . . . . 2.44 109.236 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -61.76 -36.38 80.87 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.316 -0.857 . . . . 2.08 110.218 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.21 -39.52 94.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.603 -0.726 . . . . 2.54 110.391 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -70.6 -52.45 21.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.38 -0.827 . . . . 2.26 112.206 -178.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.476 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 4.4 pt-20 -65.27 -47.04 78.08 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.884 0.698 . . . . 1.88 112.884 -177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.462 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 13.0 m -59.79 -39.26 84.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.711 0.291 . . . . 1.46 111.777 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.407 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 21.3 t80 -69.28 -41.06 77.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.632 -0.427 . . . . 1.69 110.298 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.72 -40.78 96.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.327 -0.397 . . . . 1.99 110.634 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 92.9 mt-30 -62.07 -41.78 98.52 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.226 0.536 . . . . 2.17 109.955 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.457 ' NH1' HG12 ' B' ' 5' ' ' ILE . 23.4 ttt180 -64.86 -43.81 91.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.846 -0.615 . . . . 2.17 110.573 179.47 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 13.5 mm100 -69.39 -25.33 64.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 2.41 110.466 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.71 40.36 8.28 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 111.224 -0.75 . . . . 2.74 111.224 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.4 m -135.99 155.75 77.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.292 . . . . 2.66 110.21 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.45 148.46 92.62 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.87 2.38 . . . . 2.93 112.126 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.476 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 12.6 ttt -76.44 61.32 1.7 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.498 0.666 . . . . 2.52 110.883 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.419 ' H ' ' H ' ' A' ' 61' ' ' SER . 64.0 t30 -170.1 -18.36 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.446 -0.797 . . . . 3.65 109.735 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.419 ' H ' ' H ' ' A' ' 60' ' ' ASN . 1.4 m -82.31 -12.05 58.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 2.87 111.583 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 64.2 mt -121.64 139.32 53.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.05 0.453 . . . . 2.52 111.177 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.406 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 19.9 ptt-85 -118.15 129.0 55.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.993 -0.549 . . . . 3.47 109.565 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -97.68 126.98 43.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.982 -0.553 . . . . 2.4 110.309 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 81.9 mt -113.88 137.12 52.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 3.2 110.851 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -127.17 100.38 6.07 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.495 -0.928 . . . . 2.97 108.495 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 65.55 31.79 9.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.634 -0.712 . . . . 3.64 110.555 -179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.74 -28.04 15.24 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.733 -0.667 . . . . 3.75 112.701 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -87.71 135.4 33.39 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.225 -0.287 . . . . 4.67 110.225 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -75.56 142.16 42.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.469 0.652 . . . . 3.55 111.328 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.483 HD12 HD13 ' A' ' 44' ' ' LEU . 30.3 mm -79.59 117.38 25.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.268 -0.878 . . . . 2.55 110.925 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.45 ' HB3' ' ND1' ' A' ' 75' ' ' HIS . . . -84.81 154.9 22.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.048 -0.524 . . . . 2.89 110.229 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.412 ' OD2' ' HG3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -66.99 -27.75 67.69 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.993 -0.548 . . . . 2.44 111.744 -179.051 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -89.4 4.25 49.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 3.29 111.503 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.45 ' ND1' ' HB3' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -86.37 149.16 25.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.336 0.589 . . . . 3.27 111.378 -179.35 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.1 p -117.42 157.95 46.11 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.502 -0.772 . . . . 2.53 110.09 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PRO . . . . . 0.654 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 17.0 Cg_exo -67.0 -10.71 29.54 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.441 2.094 . . . . 2.21 111.952 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -79.46 -17.56 53.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.366 0.603 . . . . 2.92 109.79 179.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -98.01 164.14 12.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.661 -0.699 . . . . 3.18 110.26 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 86.6 mt 68.68 -1.13 2.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.888 -0.597 . . . . 3.04 111.944 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.07 45.53 55.96 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.81 -0.71 . . . . 2.76 112.868 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 3.6 ttt -72.53 125.4 27.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.811 0.338 . . . . 2.41 110.229 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -114.18 -171.53 1.93 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.467 0.543 . . . . 3.44 112.467 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.94 137.45 45.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.499 -0.773 . . . . 2.34 110.229 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 54.76 38.7 30.61 Favored 'General case' 0 CA--C 1.516 -0.348 0 O-C-N 123.797 0.686 . . . . 2.55 110.863 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.02 160.11 33.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.609 -0.723 . . . . 2.28 110.404 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 99.3 t -99.16 114.06 35.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.394 0.616 . . . . 2.19 112.208 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -120.32 132.31 70.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 108.277 -1.008 . . . . 1.86 108.277 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -111.66 144.05 41.57 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.916 0.389 . . . . 2.9 111.28 -178.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.62 129.54 73.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.078 -0.51 . . . . 2.36 110.421 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -130.92 159.72 36.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.23 -0.441 . . . . 2.94 110.121 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -79.95 139.59 37.0 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.864 0.364 . . . . 3.63 111.026 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.406 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.4 mm-40 -77.38 149.83 35.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.914 -0.585 . . . . 3.61 110.855 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -73.17 -32.68 64.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.874 -0.603 . . . . 4.92 110.317 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 p -65.18 -57.18 9.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.908 -0.587 . . . . 4.41 110.128 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.35 -20.31 18.82 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.756 -0.656 . . . . 3.73 112.493 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.75 -1.028 . . . . 3.68 111.807 -179.904 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.46 HG12 ' N ' ' A' ' 37' ' ' LYS . 2.2 t . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 109.671 -0.492 . . . . 2.13 109.671 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.483 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 9.6 mt -71.77 108.71 3.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 1.61 109.707 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -73.94 107.6 6.26 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 116.157 -0.474 . . . . 2.53 110.466 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.447 ' HB2' HG12 ' A' ' 38' ' ' VAL . 12.0 mt . . . . . 0 C--N 1.314 -0.947 0 C-N-CA 119.455 -0.898 . . . . 1.77 109.966 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm . . . . . 0 C--O 1.232 0.163 0 N-CA-C 109.622 -0.51 . . . . 1.99 109.622 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.712 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -102.5 145.84 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.157 0.503 . . . . 3.07 111.689 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.0 mt -131.0 128.86 41.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.493 -0.776 . . . . 1.36 109.26 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -93.78 109.91 21.57 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.847 0.356 . . . . 2.7 110.464 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 12.4 t -85.55 123.2 39.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.62 110.747 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.6 mm -109.93 116.7 52.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.685 -0.689 . . . . 2.39 110.117 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.65 -179.93 43.33 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 2.64 112.275 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -65.88 -28.48 68.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 3.73 110.617 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -86.21 13.56 7.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.107 -0.497 . . . . 3.07 110.606 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m 59.78 48.63 8.93 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.833 0.825 . . . . 3.25 110.327 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.57 166.42 16.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.954 -1.021 . . . . 2.47 109.815 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -137.53 97.07 3.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.023 0.44 . . . . 2.99 110.243 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.7 mm -116.23 127.63 73.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.554 . . . . 1.81 109.58 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.644 ' HB3' HG13 ' B' ' 4' ' ' VAL . 0.0 OUTLIER -88.81 166.67 13.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.141 0.495 . . . . 2.04 110.826 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.712 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -143.39 131.11 21.36 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 122.246 -0.284 . . . . 1.53 111.71 -179.062 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -99.09 95.2 6.96 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.061 -0.348 . . . . 2.4 110.061 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.9 m -117.35 171.58 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 1.57 111.465 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.63 148.35 50.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.542 -0.54 . . . . 3.2 109.542 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 mtt -83.96 85.33 7.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.225 0.536 . . . . 3.01 111.032 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 16.3 m -167.74 -46.9 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.294 -1.002 . . . . 2.21 108.294 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.52 148.07 37.35 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.716 -1.129 . . . . 1.75 110.882 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.431 ' HA ' HG22 ' A' ' 76' ' ' THR . 1.4 m-70 -66.67 155.27 38.43 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.295 -0.412 . . . . 2.43 110.648 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.8 mt -69.5 -9.96 56.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.449 . . . . 1.89 110.3 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.553 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 17.8 ttpp -61.51 -40.23 93.87 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.486 -0.779 . . . . 2.44 109.103 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.3 tptp -62.6 -39.87 95.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.349 -0.841 . . . . 2.08 109.95 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.13 -44.39 87.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 2.54 110.201 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -68.88 -54.59 14.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.604 -0.726 . . . . 2.26 112.356 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.4 pt-20 -62.67 -42.58 99.69 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.788 0.662 . . . . 1.88 112.788 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.501 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 9.4 m -65.67 -34.54 78.45 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.816 -0.354 . . . . 1.46 111.22 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.49 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 7.0 t80 -70.87 -40.69 72.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.525 -0.546 . . . . 1.69 109.525 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 79.8 m -61.5 -35.22 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 1.99 109.896 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.501 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 72.8 mt-30 -63.44 -38.12 89.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.69 -0.686 . . . . 2.17 110.363 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.445 ' NH1' HG12 ' B' ' 5' ' ' ILE . 2.4 ttt180 -76.05 -38.45 57.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.367 -0.379 . . . . 2.17 110.334 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 10.8 mm100 -69.61 -22.79 63.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.063 0.459 . . . . 2.41 110.251 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.28 27.24 40.69 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.005 -0.617 . . . . 2.74 112.506 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.2 m -117.56 153.13 50.36 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.547 0.213 . . . . 2.66 110.814 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.79 173.97 11.1 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.399 2.066 . . . . 2.93 111.836 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.4 tpt -74.57 148.94 40.37 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.649 -0.25 . . . . 2.52 110.753 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 70.06 16.72 7.48 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.636 -0.711 . . . . 3.65 112.167 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.5 p -92.42 -26.62 17.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.242 0.544 . . . . 2.87 109.698 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.7 mt -121.22 146.28 46.96 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.579 -0.737 . . . . 2.52 110.227 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.444 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.5 ptt-85 -119.3 131.26 55.72 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.142 -0.688 . . . . 3.47 109.142 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.1 m-85 -99.87 133.83 43.66 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.964 -0.562 . . . . 2.4 110.675 -178.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.7 mt -115.89 131.74 56.85 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.961 -0.563 . . . . 3.2 110.665 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -134.97 114.49 12.55 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.424 -0.807 . . . . 2.97 109.069 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 62.98 23.2 13.89 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.09 0.472 . . . . 3.64 110.798 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.42 -12.55 68.74 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.953 -0.642 . . . . 3.75 112.452 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -103.51 138.48 40.16 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.663 -0.316 . . . . 4.67 110.279 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.2 ptm180 -76.28 142.37 41.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.136 0.493 . . . . 3.55 110.476 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.3 mm -75.75 117.8 20.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.798 -0.637 . . . . 2.55 111.811 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.32 157.39 18.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.663 -0.698 . . . . 2.89 109.64 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -67.85 -29.08 68.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.317 0.58 . . . . 2.44 110.629 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -82.73 -4.42 57.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.697 -0.683 . . . . 3.29 111.177 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -81.76 145.46 30.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.105 0.479 . . . . 3.27 111.058 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 21.1 p -127.47 161.07 56.98 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 2.53 109.7 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -65.39 -11.5 30.55 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.367 2.045 . . . . 2.21 111.923 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.41 -36.17 71.24 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.829 -0.623 . . . . 2.92 110.313 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 4.2 pt-20 -97.95 -178.68 4.16 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.433 -0.581 . . . . 3.18 109.433 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 23.7 mt 73.92 -49.94 0.68 Allowed 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.666 0.604 . . . . 3.04 110.896 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.06 50.74 0.62 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.998 -0.62 . . . . 2.76 112.137 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 33.3 mtt -77.39 137.23 38.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.36 . . . . 2.41 110.778 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -122.79 174.13 7.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.11 -0.496 . . . . 3.44 110.465 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -63.98 129.03 38.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 2.34 110.898 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 58.26 49.36 11.26 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.295 0.569 . . . . 2.55 110.879 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -79.31 178.58 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.652 -0.703 . . . . 2.28 110.232 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.3 t -117.74 131.79 69.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.834 0.35 . . . . 2.19 111.181 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 17.0 tt -134.81 132.5 53.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.288 -0.634 . . . . 1.86 109.288 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -98.42 151.69 20.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.77 0.319 . . . . 2.9 111.466 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -131.32 127.02 59.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.045 -0.525 . . . . 2.36 110.353 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.05 160.54 35.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.949 -0.569 . . . . 2.94 109.823 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -85.65 145.55 27.26 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.874 0.368 . . . . 3.63 110.945 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.444 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.2 mm-40 -84.62 133.27 34.42 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.179 -0.464 . . . . 3.61 110.91 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -64.6 -28.47 69.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.859 -0.61 . . . . 4.92 110.353 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -15.87 63.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 4.41 111.458 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.07 -55.04 3.28 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.004 -0.617 . . . . 3.73 112.104 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.627 -1.096 . . . . 3.68 111.518 179.903 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.644 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 109.879 -0.415 . . . . 2.13 109.879 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.589 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 23.4 mt -69.93 122.0 20.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 109.073 -0.714 . . . . 1.61 109.073 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -70.26 106.71 3.43 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.688 -0.687 . . . . 2.53 111.836 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 8.4 mt . . . . . 0 C--N 1.319 -0.733 0 N-CA-C 109.502 -0.555 . . . . 1.77 109.502 177.711 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.428 ' O ' HG22 ' A' ' 38' ' ' VAL . 45.1 mm . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.913 0.387 . . . . 1.99 110.901 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -110.23 126.81 54.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.872 0.368 . . . . 3.07 110.62 179.124 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 71.9 mt -104.38 132.77 50.26 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.242 -0.651 . . . . 1.36 109.242 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 86' ' ' ASP . 1.7 ptpm? -99.5 113.42 25.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 2.7 110.598 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.648 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.2 t -83.41 121.1 35.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.064 -0.971 . . . . 1.62 110.003 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.533 ' HA ' ' O ' ' A' ' 32' ' ' SER . 43.2 mm -105.78 124.76 61.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.254 -0.43 . . . . 2.39 110.946 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.4 178.82 35.76 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.826 -0.624 . . . . 2.64 112.187 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -70.01 -31.03 68.49 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 3.73 111.03 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -87.61 24.46 1.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.937 0.399 . . . . 3.07 111.085 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.5 m 62.01 37.96 14.51 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.636 -0.711 . . . . 3.25 111.649 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.533 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 1.2 p -91.07 145.96 24.25 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.212 -0.449 . . . . 2.47 110.363 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -127.76 118.8 24.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.978 0.418 . . . . 2.99 110.315 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.2 mt -120.27 130.57 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 1.81 109.482 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.668 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 14.6 m170 -88.21 148.53 24.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.508 . . . . 2.04 110.987 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -133.65 113.09 11.99 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.135 -0.484 . . . . 1.53 110.852 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.445 ' HB2' HG22 ' B' ' 4' ' ' VAL . 6.1 ttmt -81.36 101.42 9.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 2.4 110.431 179.081 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.428 HG22 ' O ' ' A' ' 22' ' ' ILE . 5.3 m -108.06 156.88 8.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.361 . . . . 1.57 110.718 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -113.83 129.66 56.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.193 -0.458 . . . . 3.2 109.89 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.7 ttp -71.44 85.53 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.287 0.565 . . . . 3.01 110.263 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 21.8 m -165.04 -59.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.33 -0.85 . . . . 2.21 109.082 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 149.45 29.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.346 -0.843 . . . . 1.75 111.134 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.71 -178.92 2.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.154 -0.475 . . . . 2.43 110.37 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.406 HD13 HG23 ' A' ' 71' ' ' ILE . 1.5 mt -78.34 -3.37 42.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.438 -0.346 . . . . 1.89 111.27 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -61.73 -53.24 58.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.991 0.424 . . . . 2.44 110.179 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -65.43 -36.16 83.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.874 -0.603 . . . . 2.08 110.721 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.62 -43.34 99.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.916 -0.583 . . . . 2.54 111.274 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -66.64 -50.34 63.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.209 0.448 . . . . 2.26 112.209 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.4 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 6.7 pt-20 -64.55 -43.53 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.68 0.622 . . . . 1.88 112.68 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 m -64.62 -33.07 75.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.61 0.243 . . . . 1.46 111.361 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -68.6 -42.46 78.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.907 -0.405 . . . . 1.69 109.907 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.34 -35.33 78.76 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 1.99 110.809 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.4 -35.85 82.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 2.17 110.453 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -72.17 -34.54 68.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 2.17 110.76 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -81.31 -13.62 58.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 2.41 110.497 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.09 39.67 44.64 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.163 -0.542 . . . . 2.74 112.63 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.6 m -137.5 156.0 75.14 Favored Pre-proline 0 C--N 1.328 -0.351 0 N-CA-C 110.408 -0.219 . . . . 2.66 110.408 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.31 146.8 90.61 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.666 2.244 . . . . 2.93 112.645 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.4 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 5.2 ttt -78.5 55.29 1.59 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.892 -0.594 . . . . 2.52 111.097 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -156.87 -16.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.112 -0.494 . . . . 3.65 111.167 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.7 p -96.62 -8.61 31.25 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.119 -0.232 . . . . 2.87 111.256 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 23.0 mt -115.35 126.74 54.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.9 0.381 . . . . 2.52 110.633 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.1 ptt-85 -115.06 128.67 56.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 3.47 110.019 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -96.14 132.78 41.19 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.785 -0.643 . . . . 2.4 109.65 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.5 mt -118.29 142.58 47.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.027 0.442 . . . . 3.2 111.319 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -135.43 107.06 6.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.278 -0.874 . . . . 2.97 109.034 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 61.09 34.04 19.26 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.052 0.454 . . . . 3.64 111.175 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.57 -19.76 42.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.018 -0.611 . . . . 3.75 112.759 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -89.9 133.86 34.53 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.15 -0.315 . . . . 4.67 110.15 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.1 ptm85 -77.76 138.4 38.99 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.299 -0.56 . . . . 3.55 110.324 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.406 HG23 HD13 ' A' ' 44' ' ' LEU . 42.3 mm -79.27 111.35 16.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.648 -0.706 . . . . 2.55 111.267 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.29 162.77 22.17 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 2.89 109.832 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.88 -30.85 71.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.862 -0.608 . . . . 2.44 111.476 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -82.84 4.22 26.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 3.29 112.031 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -81.05 164.96 22.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.826 0.346 . . . . 3.27 110.841 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.429 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 8.9 t -155.77 146.21 16.03 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.438 -0.579 . . . . 2.53 109.438 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.56 -17.07 16.0 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.953 2.435 . . . . 2.21 112.927 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -73.32 -15.83 61.38 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.228 -0.442 . . . . 2.92 110.787 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 12.5 pt-20 -119.38 171.4 8.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 3.18 109.496 178.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 92.2 mt 73.13 -3.23 2.5 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.668 0.605 . . . . 3.04 111.153 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.81 47.3 40.58 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 121.033 -0.604 . . . . 2.76 113.053 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 10.1 mtt -73.2 131.57 42.16 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.858 -0.423 . . . . 2.41 109.858 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 46.1 mt-10 -119.93 178.7 4.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.068 0.461 . . . . 3.44 111.606 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -67.92 138.83 56.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.483 -0.78 . . . . 2.34 110.535 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 57.59 39.05 27.98 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.593 0.558 . . . . 2.55 110.641 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 25' ' ' LYS . 1.0 OUTLIER -77.47 164.76 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.015 -0.538 . . . . 2.28 110.39 -179.803 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.0 t -103.19 132.86 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.144 0.497 . . . . 2.19 111.877 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.648 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -132.98 127.82 55.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.691 -0.855 . . . . 1.86 108.691 178.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -103.89 142.14 34.92 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.69 0.281 . . . . 2.9 111.036 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.9 p -121.43 126.96 75.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.162 0.506 . . . . 2.36 110.206 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -130.72 165.46 22.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.896 -0.593 . . . . 2.94 109.693 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -96.24 139.05 32.95 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.943 0.402 . . . . 3.63 110.906 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.92 146.5 39.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.873 -0.603 . . . . 3.61 109.584 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -69.42 -25.7 64.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.433 -0.349 . . . . 4.92 111.303 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.93 -18.51 62.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.232 -0.44 . . . . 4.41 111.437 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.88 -1.27 79.77 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.809 -0.71 . . . . 3.73 112.593 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.944 -0.92 . . . . 3.68 111.337 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.668 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 12.2 p . . . . . 0 N--CA 1.442 -0.826 0 CA-C-O 122.062 0.934 . . . . 2.13 110.624 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.446 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 6.4 mt -77.81 117.2 22.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 114.607 -1.179 . . . . 1.61 109.859 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.29 106.31 8.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.805 0.336 . . . . 2.53 110.909 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.413 HD22 ' CZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER . . . . . 0 C--N 1.314 -0.96 0 CA-C-O 121.521 0.676 . . . . 1.77 109.346 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mm . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.547 0.213 . . . . 1.99 111.204 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HB2' ' NZ ' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -121.28 119.27 31.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.343 -0.389 . . . . 3.07 110.046 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 87.1 mt -103.51 144.59 31.21 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.221 -0.445 . . . . 1.36 110.0 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 mttp -99.81 103.08 14.68 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.313 -0.403 . . . . 2.7 110.625 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 11.0 t -88.03 124.94 41.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.922 -0.581 . . . . 1.62 109.534 179.221 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 32' ' ' SER . 10.8 mm -119.37 137.41 53.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.014 0.435 . . . . 2.39 111.533 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -112.18 172.76 14.96 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.923 -0.58 . . . . 2.64 111.969 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 31.6 tp60 -65.52 -20.36 66.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.166 0.507 . . . . 3.73 111.325 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -89.31 18.42 5.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.389 -0.369 . . . . 3.07 110.678 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.4 m 59.36 39.93 21.64 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.67 -0.696 . . . . 3.25 111.239 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 2.0 p -91.01 142.86 27.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.766 -0.652 . . . . 2.47 110.174 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -121.97 114.69 21.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.06 0.457 . . . . 2.99 110.063 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.4 mm -126.03 133.55 68.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.979 -0.555 . . . . 1.81 110.473 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.644 ' HB3' HG13 ' B' ' 4' ' ' VAL . 0.2 OUTLIER -91.99 150.2 21.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.061 0.458 . . . . 2.04 110.219 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.549 ' HE1' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -131.11 108.58 9.85 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.315 -0.402 . . . . 1.53 111.832 -178.873 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.576 ' HG3' HG11 ' B' ' 4' ' ' VAL . 11.8 mtmt -81.58 101.51 10.04 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.749 -0.463 . . . . 2.4 109.749 178.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.464 HG11 HD23 ' A' ' 47' ' ' LEU . 17.1 m -115.85 166.94 9.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.175 0.512 . . . . 1.57 112.287 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -115.04 136.51 53.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.322 -0.854 . . . . 3.2 108.987 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 43.4 ttp -78.3 85.31 4.44 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.754 0.311 . . . . 3.01 110.495 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.45 -44.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.605 -0.725 . . . . 2.21 109.853 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 148.17 36.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.683 -0.69 . . . . 1.75 111.266 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -67.17 167.85 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 2.43 110.362 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.409 HD13 HD12 ' A' ' 71' ' ' ILE . 78.7 mt -75.29 -3.81 35.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 1.89 111.08 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.88 -47.2 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.261 -0.644 . . . . 2.44 109.261 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -57.09 -40.1 76.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.272 -0.876 . . . . 2.08 110.73 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.464 HD23 HG11 ' A' ' 38' ' ' VAL . 1.4 tm? -57.03 -39.2 74.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.587 -0.733 . . . . 2.54 110.895 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -79.0 -55.33 5.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.8 -0.636 . . . . 2.26 112.518 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -44.48 94.91 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.017 0.747 . . . . 1.88 113.017 -177.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.606 ' HB3' HD11 ' B' ' 7' ' ' LEU . 63.3 m -62.91 -35.33 79.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.624 0.193 . . . . 1.46 111.229 -179.181 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -66.9 -45.35 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.577 -0.527 . . . . 1.69 109.577 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 59.5 m -62.17 -37.36 84.96 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.823 -0.626 . . . . 1.99 110.342 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -61.32 -44.45 97.18 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.975 -0.557 . . . . 2.17 111.13 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.417 ' CZ ' HG12 ' B' ' 5' ' ' ILE . 10.4 ttp180 -76.41 -24.49 54.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.846 0.355 . . . . 2.17 110.837 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -75.48 -33.79 60.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.361 -0.382 . . . . 2.41 110.266 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.44 32.34 6.7 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.766 -0.652 . . . . 2.74 111.851 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.21 152.26 79.83 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 122.928 -0.16 . . . . 2.66 110.595 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.47 154.39 74.51 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.646 2.231 . . . . 2.93 112.129 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.497 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 11.3 tpt -66.59 145.53 55.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.256 -0.429 . . . . 2.52 110.572 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.3 m120 76.54 10.18 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.523 0.729 . . . . 3.65 112.344 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.7 p -90.38 -17.71 26.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.297 -0.631 . . . . 2.87 109.297 178.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 92' ' ' GLN . 72.6 mt -124.15 149.13 46.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.362 -0.835 . . . . 2.52 110.092 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.529 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 32.5 ptt-85 -119.2 128.61 54.38 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.042 0.449 . . . . 3.47 109.886 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.411 ' HB3' HD11 ' A' ' 88' ' ' ILE . 68.3 m-85 -95.81 132.71 40.77 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.946 -0.57 . . . . 2.4 109.841 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.8 mt -112.47 138.59 49.01 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.212 0.529 . . . . 3.2 111.307 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -138.41 110.12 7.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 2.97 108.51 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 64.52 31.92 12.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.939 -0.573 . . . . 3.64 110.873 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.53 -31.53 6.72 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.858 -0.686 . . . . 3.75 113.173 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -87.62 161.41 17.71 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.435 -0.209 . . . . 4.67 110.435 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.2 ptm180 -94.04 143.66 26.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.968 0.413 . . . . 3.55 110.584 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.409 HD12 HD13 ' A' ' 44' ' ' LEU . 30.4 mm -78.46 121.57 31.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.858 -0.61 . . . . 2.55 111.81 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -88.74 157.19 18.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 2.89 109.891 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -68.9 -22.28 64.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.385 -0.37 . . . . 2.44 111.884 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -95.17 8.68 42.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.682 0.277 . . . . 3.29 111.625 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -90.79 153.42 20.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.777 0.322 . . . . 3.27 110.403 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.6 p -123.18 161.38 45.31 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.236 -0.438 . . . . 2.53 111.307 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -68.54 -17.89 43.32 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.685 2.257 . . . . 2.21 111.845 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.1 -42.49 66.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.895 -0.593 . . . . 2.92 110.546 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.425 ' HG3' ' HG ' ' A' ' 80' ' ' LEU . 15.1 pt-20 -84.09 176.01 9.1 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.102 -0.499 . . . . 3.18 110.243 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.425 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 33.1 mt 73.38 -42.56 0.53 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.502 0.721 . . . . 3.04 111.88 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.41 54.29 0.66 Allowed Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.648 -0.581 . . . . 2.76 111.648 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.7 ttm -90.47 115.58 27.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.955 0.407 . . . . 2.41 110.15 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 34.5 mt-10 -103.53 -178.74 3.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.065 -0.516 . . . . 3.44 111.375 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.523 ' HG3' ' HG2' ' A' ' 85' ' ' GLU . 10.1 tp10 -73.4 142.81 46.96 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.109 -0.7 . . . . 2.34 109.109 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.523 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 81.2 mm-40 60.32 41.27 16.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.194 0.521 . . . . 2.55 109.923 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.4 t0 -85.55 172.46 10.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 2.28 110.973 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.4 t -117.92 138.72 47.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.04 0.447 . . . . 2.19 111.668 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.524 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 10.4 tt -142.54 127.92 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.536 -0.756 . . . . 1.86 109.035 178.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -97.95 160.0 14.58 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.896 0.379 . . . . 2.9 111.452 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 p -138.1 127.57 33.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.935 -0.575 . . . . 2.36 109.916 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -132.85 153.21 51.54 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.455 -0.339 . . . . 2.94 110.392 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.545 ' HA ' HD23 ' A' ' 62' ' ' LEU . 41.2 tt0 -78.48 134.57 37.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.281 -0.418 . . . . 3.63 110.91 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.529 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.9 mm-40 -78.01 143.19 37.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.182 -0.463 . . . . 3.61 110.026 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -62.35 -23.75 66.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.95 -0.568 . . . . 4.92 111.001 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.4 p -71.84 -30.37 65.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.782 -0.645 . . . . 4.41 110.763 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.91 15.07 81.66 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.761 -0.654 . . . . 3.73 112.233 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.88 0 CA-C-O 119.161 -0.799 . . . . 3.68 111.346 -179.858 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.644 HG13 ' HB3' ' A' ' 35' ' ' HIS . 1.9 t . . . . . 0 N--CA 1.446 -0.628 0 CA-C-O 120.9 0.381 . . . . 2.13 111.163 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' ILE . . . . . 0.528 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 16.2 mt -70.91 128.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.077 -0.712 . . . . 1.61 109.077 178.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -80.6 105.85 12.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.832 0.348 . . . . 2.53 111.147 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.606 HD11 ' HB3' ' A' ' 50' ' ' SER . 1.3 tp . . . . . 0 C--N 1.316 -0.875 0 N-CA-C 108.452 -0.944 . . . . 1.77 108.452 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 110.161 -0.311 . . . . 2.72 110.161 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm -90.38 135.0 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 110.205 -0.294 . . . . 1.99 110.205 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.0 ttpm? -113.72 120.22 40.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.29 0.567 . . . . 3.07 111.538 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.5 mt -104.18 150.24 24.55 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.139 -0.689 . . . . 1.36 109.139 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -103.93 121.39 43.03 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.92 -0.312 . . . . 2.7 110.878 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.6 t -93.08 121.39 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.904 -0.589 . . . . 1.62 109.988 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.4 mm -103.37 120.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.907 0.384 . . . . 2.39 111.017 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.58 167.87 24.83 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.653 -0.703 . . . . 2.64 111.583 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -77.01 -17.71 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.116 0.484 . . . . 3.73 110.639 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -85.88 20.96 2.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.465 . . . . 3.07 110.364 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 58.96 64.3 1.44 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.596 -0.729 . . . . 3.25 110.91 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -135.76 144.58 45.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.491 -0.777 . . . . 2.47 110.462 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -126.04 94.3 4.06 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.443 -0.577 . . . . 2.99 109.443 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.425 ' HA ' HG11 ' B' ' 2' ' ' VAL . 9.8 mm -90.5 145.4 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.056 -0.52 . . . . 1.81 110.9 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 32.6 m170 -89.02 132.98 34.5 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.888 -0.782 . . . . 2.04 108.888 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.453 ' CE1' HD12 ' B' ' 7' ' ' LEU . 0.8 OUTLIER -123.16 110.52 15.37 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.817 0.341 . . . . 1.53 110.884 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.574 ' HB2' HG22 ' B' ' 4' ' ' VAL . 24.3 ttmt -81.48 110.65 17.08 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.949 -0.569 . . . . 2.4 110.712 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.7 m -114.13 154.69 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.088 0.47 . . . . 1.57 110.465 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.519 ' HG2' HG22 ' A' ' 41' ' ' THR . 52.6 tttt -106.67 127.27 53.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.378 -0.374 . . . . 3.2 110.143 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.647 ' O ' ' HB ' ' A' ' 41' ' ' THR . 63.1 tpp -74.3 85.88 1.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 3.01 110.565 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.647 ' HB ' ' O ' ' A' ' 40' ' ' MET . 7.4 t 154.31 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.274 1.03 . . . . 2.21 109.055 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.6 m -84.33 134.89 34.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.867 -0.606 . . . . 1.75 110.573 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.15 132.95 54.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.929 -0.578 . . . . 2.43 110.104 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.93 -18.45 60.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 1.89 110.833 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 34.0 tptt -53.9 -47.41 71.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.265 0.555 . . . . 2.44 109.764 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.9 -43.35 83.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.257 -0.883 . . . . 2.08 111.063 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -44.76 96.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.836 0.351 . . . . 2.54 111.077 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -61.25 -52.82 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.041 -0.527 . . . . 2.26 112.354 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.7 pt-20 -63.32 -44.12 95.86 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.422 0.527 . . . . 1.88 112.422 -178.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.68 ' HB2' HD13 ' B' ' 7' ' ' LEU . 3.9 m -65.55 -33.44 75.93 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.275 -0.17 . . . . 1.46 111.347 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -69.31 -37.28 77.7 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.574 -0.45 . . . . 1.69 110.012 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 66.7 m -60.95 -39.7 90.48 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.256 -0.646 . . . . 1.99 109.256 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 85.1 mt-30 -63.79 -39.65 94.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.283 -0.872 . . . . 2.17 110.156 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -64.84 -33.62 76.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.055 0.455 . . . . 2.17 109.788 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -70.87 -35.59 72.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.862 -0.608 . . . . 2.41 110.03 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.65 20.63 8.81 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.01 -0.614 . . . . 2.74 112.088 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.7 m -132.62 155.83 80.78 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.438 -0.208 . . . . 2.66 110.438 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.51 164.03 36.75 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.239 1.959 . . . . 2.93 111.217 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 12.3 ttt -71.27 163.04 28.42 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 121.172 -0.211 . . . . 2.52 110.564 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' MET . 16.2 m120 75.7 -0.85 3.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.301 0.64 . . . . 3.65 111.843 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.6 p -85.26 -29.96 24.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.19 0.519 . . . . 2.87 109.809 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.6 mt -119.59 146.13 45.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.472 -0.786 . . . . 2.52 110.594 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -110.8 134.04 52.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.982 -0.554 . . . . 3.47 110.023 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -96.44 120.53 36.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 2.4 109.315 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.5 mt -108.19 130.57 55.13 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.284 0.564 . . . . 3.2 111.572 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -127.46 108.2 10.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.076 -0.965 . . . . 2.97 108.409 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.94 17.46 10.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 3.64 111.013 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.77 -26.65 20.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.085 -0.579 . . . . 3.75 112.285 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -87.03 145.9 26.31 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.87 -0.419 . . . . 4.67 109.87 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -81.42 133.71 35.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.219 0.533 . . . . 3.55 110.383 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.403 HD13 ' HA ' ' A' ' 71' ' ' ILE . 24.0 mm -74.2 113.89 13.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.818 -0.628 . . . . 2.55 110.318 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HB3' ' CD2' ' A' ' 75' ' ' HIS . . . -72.38 155.72 39.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.809 -0.632 . . . . 2.89 110.497 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -65.23 -34.73 79.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.364 0.602 . . . . 2.44 110.434 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -86.99 34.24 0.67 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.523 -0.762 . . . . 3.29 111.977 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.427 ' CD2' ' HB3' ' A' ' 72' ' ' ALA . 17.2 m170 -114.91 159.34 20.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.11 0.481 . . . . 3.27 111.086 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.493 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 3.0 p -133.83 157.69 77.21 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.657 -0.702 . . . . 2.53 109.761 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -64.28 -14.29 43.04 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.412 2.075 . . . . 2.21 112.762 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -68.37 -36.35 79.06 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.217 -0.447 . . . . 2.92 110.673 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.07 177.65 5.91 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.422 -0.584 . . . . 3.18 109.422 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.6 mt 73.62 -47.29 0.65 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 123.652 0.595 . . . . 3.04 110.825 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.71 47.06 0.75 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.091 -0.576 . . . . 2.76 111.858 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.6 mtt -77.85 132.98 38.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.945 0.402 . . . . 2.41 110.62 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 32.3 mt-10 -126.2 177.04 6.64 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.121 -0.491 . . . . 3.44 110.788 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.416 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.7 tp10 -71.87 143.13 49.51 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.088 -0.708 . . . . 2.34 109.088 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 66.64 28.42 9.19 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.504 0.503 . . . . 2.55 110.577 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.2 t0 -74.59 168.92 18.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.032 -0.531 . . . . 2.28 110.403 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.5 t -120.19 124.62 73.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.754 0.311 . . . . 2.19 111.245 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -125.31 133.05 70.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.572 -0.529 . . . . 1.86 109.572 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.11 150.57 23.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.914 0.388 . . . . 2.9 111.217 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -133.96 128.12 52.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.002 -0.545 . . . . 2.36 110.521 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -132.96 162.25 32.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.262 -0.426 . . . . 2.94 110.09 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -89.97 134.88 33.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.021 0.439 . . . . 3.63 110.981 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -72.39 150.26 43.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 3.61 109.624 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -63.14 -35.97 82.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.388 -0.369 . . . . 4.92 111.509 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 p -68.13 -31.63 71.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.859 0.361 . . . . 4.41 111.212 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.57 -10.05 68.92 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.017 -0.611 . . . . 3.73 111.941 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.707 -1.052 . . . . 3.68 111.974 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 56.1 mmtt . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.01 -0.367 . . . . 7.46 110.01 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.425 HG11 ' HA ' ' A' ' 34' ' ' ILE . 2.1 t -77.39 148.6 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.493 -0.558 . . . . 2.65 109.493 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -68.41 138.19 55.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.812 0.339 . . . . 2.5 110.654 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.574 HG22 ' HB2' ' A' ' 37' ' ' LYS . 12.1 p -97.3 124.35 50.14 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 N-CA-C 108.603 -0.888 . . . . 2.13 108.603 179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.472 HG22 ' HG ' ' B' ' 7' ' ' LEU . 3.9 mt -68.86 104.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.701 -0.682 . . . . 1.61 110.33 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -83.16 104.6 13.47 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.836 -0.62 . . . . 2.53 110.486 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' A' ' 50' ' ' SER . 96.7 mt -135.09 12.7 3.59 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.238 0.542 . . . . 1.77 109.678 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 17.4 p -72.65 133.35 44.6 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.632 -0.713 . . . . 3.0 110.77 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 38.8 mt -67.55 94.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.294 0.568 . . . . 3.74 110.371 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -156.24 -63.5 0.11 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.941 -1.027 . . . . 6.22 108.449 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 1.4 m -100.55 141.47 33.36 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.369 -0.832 . . . . 5.71 109.132 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 10.1 m -74.19 87.27 1.93 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.965 0.412 . . . . 6.23 110.582 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.2 m -130.72 17.68 5.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.317 0.488 . . . . 5.9 112.317 -178.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 19.7 t0 . . . . . 0 C--N 1.327 -0.404 0 C-N-CA 120.747 -0.381 . . . . 5.62 110.304 179.296 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.716 ' CD2' HG21 ' B' ' 8' ' ' THR . 20.1 m-85 . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 109.51 -0.552 . . . . 2.72 109.51 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.9 mm -73.35 119.4 20.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.787 0.327 . . . . 1.99 110.736 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.645 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -97.69 123.37 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 3.07 110.678 179.201 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 36' ' ' PHE . 70.8 mt -110.58 118.2 35.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.871 -0.604 . . . . 1.36 109.517 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -80.83 109.32 15.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.905 0.383 . . . . 2.7 110.631 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.1 t -81.02 115.46 23.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.734 -0.666 . . . . 1.62 109.999 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.5 mm -107.3 126.97 63.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.031 -0.531 . . . . 2.39 110.707 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.57 172.32 21.9 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.797 -0.716 . . . . 2.64 111.855 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -64.72 -23.07 67.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.163 0.506 . . . . 3.73 111.113 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.71 15.87 5.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.214 -0.448 . . . . 3.07 110.634 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.5 m 61.92 37.01 15.48 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.958 -0.565 . . . . 3.25 111.036 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -86.39 152.14 22.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.856 -0.611 . . . . 2.47 110.798 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -125.99 115.64 20.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.266 -0.424 . . . . 2.99 110.323 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.422 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 70.4 mt -125.97 139.38 51.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.51 -0.552 . . . . 1.81 109.51 179.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.843 ' HB3' HG13 ' B' ' 4' ' ' VAL . 10.5 m170 -88.54 158.44 18.3 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.184 0.516 . . . . 2.04 111.176 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.645 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.05 120.12 12.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.279 -0.419 . . . . 1.53 110.765 -179.365 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.505 ' N ' HG12 ' B' ' 4' ' ' VAL . 5.2 mtmt -100.02 96.87 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.664 0.268 . . . . 2.4 110.376 179.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 m -113.8 162.66 11.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.896 0.379 . . . . 1.57 110.945 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.5 tttt -128.28 141.43 51.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.189 -0.46 . . . . 3.2 109.899 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.6 ttm -78.09 84.99 4.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.303 0.573 . . . . 3.01 110.331 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 16.2 m -163.74 -46.32 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.327 -0.852 . . . . 2.21 109.115 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.69 149.07 22.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.296 -0.865 . . . . 1.75 111.507 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -63.93 152.59 39.5 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.27 -0.423 . . . . 2.43 110.42 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.7 mt -67.82 -11.86 59.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.766 0.317 . . . . 1.89 111.177 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -65.85 -30.71 71.37 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.343 -0.614 . . . . 2.44 109.343 178.64 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.436 ' N ' ' HG3' ' A' ' 45' ' ' LYS . 42.4 tptt -68.88 -32.73 72.6 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.5 -0.773 . . . . 2.08 109.074 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' B' ' 7' ' ' LEU . 0.5 OUTLIER -68.81 -41.69 78.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.195 -0.911 . . . . 2.54 110.043 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -64.5 -51.78 61.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.464 -0.789 . . . . 2.26 111.834 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.6 pt-20 -66.29 -43.64 85.75 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.302 0.482 . . . . 1.88 112.302 -178.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.44 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 50.3 m -61.46 -36.58 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 122.4 -0.187 . . . . 1.46 111.384 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -68.88 -38.54 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.822 -0.436 . . . . 1.69 109.822 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 75.4 m -63.13 -42.27 99.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 1.99 109.698 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.44 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.7 mt-30 -64.99 -35.62 81.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.853 -0.612 . . . . 2.17 110.2 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.08 -42.45 80.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.744 -0.662 . . . . 2.17 110.778 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -79.23 -11.81 59.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 2.41 111.332 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.5 31.67 44.93 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.014 -0.612 . . . . 2.74 112.632 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.9 m -121.78 156.53 58.93 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 122.892 -0.181 . . . . 2.66 110.731 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -69.54 159.99 51.45 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.642 2.228 . . . . 2.93 112.103 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.8 145.58 53.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.234 -0.439 . . . . 2.52 111.16 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 71.64 16.81 5.7 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.702 0.801 . . . . 3.65 112.541 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.2 p -92.42 -27.6 17.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.461 0.648 . . . . 2.87 109.611 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.3 mt -111.66 141.75 44.86 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.21 -0.904 . . . . 2.52 110.245 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.467 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 11.4 ptt180 -107.92 118.95 38.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.546 -0.539 . . . . 3.47 109.546 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.04 124.81 35.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.619 -0.719 . . . . 2.4 109.748 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.7 mt -114.34 136.7 52.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.335 0.588 . . . . 3.2 112.052 -178.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.408 ' HB2' HD11 ' A' ' 71' ' ' ILE . 78.7 t80 -129.94 107.47 9.39 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.741 -1.118 . . . . 2.97 108.521 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 61.27 35.23 18.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.979 -0.555 . . . . 3.64 110.982 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.3 -5.42 84.42 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.865 -0.607 . . . . 3.75 113.202 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -104.48 148.0 26.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.152 -0.314 . . . . 4.67 110.152 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 70' ' ' ARG . 12.4 ptm180 -85.94 139.47 31.18 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.43 -0.508 . . . . 3.55 110.476 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 66' ' ' PHE . 37.4 mm -75.27 113.82 14.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.839 -0.619 . . . . 2.55 111.403 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.13 161.42 22.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.161 -0.472 . . . . 2.89 110.047 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.5 -23.82 58.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.252 -0.431 . . . . 2.44 110.971 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -90.56 3.17 54.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.307 -0.406 . . . . 3.29 110.82 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -85.14 147.08 26.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 3.27 110.512 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 40.1 p -126.11 160.93 54.69 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.077 -0.511 . . . . 2.53 110.14 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.37 -7.92 21.54 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.503 2.135 . . . . 2.21 112.023 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -76.23 -31.34 58.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.829 -0.623 . . . . 2.92 110.365 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.4 pt-20 -102.33 -171.01 1.89 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 3.18 110.355 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 62.2 mt 72.72 -36.24 0.35 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.523 0.729 . . . . 3.04 111.924 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 104.65 35.02 3.38 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.944 -0.646 . . . . 2.76 111.856 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.1 mtt -70.12 129.1 38.5 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.913 0.387 . . . . 2.41 111.091 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -126.76 176.27 7.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.054 -0.521 . . . . 3.44 110.17 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -64.23 142.71 58.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.182 -0.463 . . . . 2.34 110.398 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 54.66 50.68 15.36 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.672 0.608 . . . . 2.55 111.221 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.68 -175.61 4.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.418 -0.356 . . . . 2.28 110.366 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.95 138.67 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 2.19 111.407 -178.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.471 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 14.9 tt -137.11 132.27 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.146 -0.687 . . . . 1.86 109.146 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -104.36 146.21 29.15 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.596 0.236 . . . . 2.9 110.663 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p -131.47 129.95 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.046 0.45 . . . . 2.36 110.431 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -134.68 162.79 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.035 -0.53 . . . . 2.94 110.135 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -83.9 135.6 34.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.602 -0.272 . . . . 3.63 110.852 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.467 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 7.1 mm-40 -77.19 146.91 36.75 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.113 -0.328 . . . . 3.61 110.113 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -68.13 -26.0 65.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.868 0.366 . . . . 4.92 110.792 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -35.19 79.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.15 -0.477 . . . . 4.41 111.125 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.11 -37.65 3.37 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.886 -0.673 . . . . 3.73 112.203 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.909 0 CA-C-O 118.7 -1.056 . . . . 3.68 111.762 179.904 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 72.1 mttt . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 110.102 -0.333 . . . . 7.46 110.102 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.9 t -117.4 105.89 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 N-CA-C 109.507 -0.553 . . . . 2.65 109.507 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -119.15 143.42 47.22 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.179 -0.674 . . . . 2.5 109.179 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.843 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.2 OUTLIER -94.99 106.6 18.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.664 0.268 . . . . 2.13 110.853 -178.677 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.419 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 13.7 mt -69.72 115.98 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.479 -0.563 . . . . 1.61 109.479 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ASP . . . . . 0.462 ' O ' HD23 ' B' ' 7' ' ' LEU . 20.4 m-20 -72.27 106.13 4.32 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 116.665 -0.243 . . . . 2.53 110.948 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.493 ' CD1' ' HA ' ' A' ' 47' ' ' LEU . 11.2 mt -120.13 7.1 10.77 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.682 -0.488 . . . . 1.77 109.682 178.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' THR . . . . . 0.716 HG21 ' CD2' ' A' ' 21' ' ' TYR . 56.9 p -64.94 102.41 0.6 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.804 -0.634 . . . . 3.0 111.041 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 27.5 mt -129.54 126.51 63.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.794 -0.447 . . . . 3.74 109.794 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -91.35 -39.33 12.09 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.853 -0.339 . . . . 6.22 110.955 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.29 -57.3 0.49 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.613 -0.267 . . . . 5.71 111.464 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 3.9 p -166.75 -86.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.977 0.418 . . . . 6.23 111.446 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -94.48 50.59 1.36 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.974 -0.557 . . . . 5.9 111.274 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 116.279 -0.419 . . . . 5.62 109.989 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.456 ' CZ ' ' HB ' ' B' ' 8' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.033 -0.358 . . . . 2.72 110.033 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 84' ' ' GLU . 32.3 mm -73.26 122.1 25.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.869 -0.419 . . . . 1.99 109.869 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.565 ' HE3' ' CD2' ' A' ' 35' ' ' HIS . 9.6 ttpt -98.62 119.34 37.18 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.352 -0.385 . . . . 3.07 110.462 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 85.5 mt -101.58 142.18 33.34 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.929 -0.578 . . . . 1.36 110.012 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -97.69 103.08 14.99 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.798 -0.445 . . . . 2.7 109.798 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.9 t -82.37 116.08 25.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.108 -0.497 . . . . 1.62 110.045 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.526 ' HA ' ' O ' ' A' ' 32' ' ' SER . 38.1 mm -108.16 123.25 63.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.928 -0.578 . . . . 2.39 111.159 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.72 177.93 32.09 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.73 -0.748 . . . . 2.64 111.591 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -69.0 -20.47 64.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.237 0.542 . . . . 3.73 110.471 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -86.18 11.7 11.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.58 -0.736 . . . . 3.07 110.343 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.1 m 62.0 34.11 16.87 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.394 -0.821 . . . . 3.25 111.968 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 29.1 p -92.57 150.19 20.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.318 -0.623 . . . . 2.47 109.318 178.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.442 ' O ' HG11 ' B' ' 2' ' ' VAL . 2.0 mt-10 -124.36 112.77 17.35 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.977 -0.379 . . . . 2.99 109.977 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.665 ' HA ' HG11 ' B' ' 2' ' ' VAL . 15.8 mm -111.96 142.78 23.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.791 -0.448 . . . . 1.81 109.791 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.565 ' CD2' ' HE3' ' A' ' 23' ' ' LYS . 47.5 m170 -91.35 140.26 29.94 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.923 0.392 . . . . 2.04 110.17 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.589 ' HE1' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -131.67 121.69 24.7 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.332 0.493 . . . . 1.53 112.332 -178.385 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.49 ' HE3' ' HB ' ' B' ' 4' ' ' VAL . 32.0 mttt -81.39 99.46 8.71 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.557 -0.292 . . . . 2.4 110.474 177.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.7 p -115.53 163.7 12.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.983 0.42 . . . . 1.57 111.06 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.32 144.06 46.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.419 -0.355 . . . . 3.2 110.154 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.6 84.67 7.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.223 0.535 . . . . 3.01 109.744 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -166.8 -60.31 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.653 -0.869 . . . . 2.21 108.653 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.7 m -76.45 148.46 37.24 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.919 -1.037 . . . . 1.75 110.304 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.437 ' HA ' HG22 ' A' ' 76' ' ' THR . 12.8 m-70 -62.12 156.73 20.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.001 0.429 . . . . 2.43 111.145 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.09 -5.41 35.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.038 -0.528 . . . . 1.89 110.588 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -61.9 -42.91 99.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.496 -0.774 . . . . 2.44 109.182 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -61.94 -39.3 91.63 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.584 -0.735 . . . . 2.08 109.628 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.441 HD22 ' HA ' ' A' ' 47' ' ' LEU . 0.9 OUTLIER -59.65 -38.39 81.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.293 -0.867 . . . . 2.54 110.184 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -73.05 -52.63 13.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.71 . . . . 2.26 112.512 -178.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.488 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 10.0 pt-20 -67.66 -44.31 78.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.936 0.717 . . . . 1.88 112.936 -177.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.436 ' HB3' HD11 ' B' ' 7' ' ' LEU . 15.0 m -59.16 -34.94 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.794 0.331 . . . . 1.46 111.172 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.402 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 27.9 t80 -66.38 -44.1 84.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.048 0.451 . . . . 1.69 109.818 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 58.0 m -61.66 -33.92 74.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.425 -0.807 . . . . 1.99 110.79 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 97.5 mt-30 -63.31 -40.37 97.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 2.17 110.975 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 -74.07 -33.53 63.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 2.17 110.619 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 12.4 mm100 -79.79 -8.34 59.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.993 0.425 . . . . 2.41 110.77 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.79 36.06 66.23 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.998 -0.546 . . . . 2.74 113.14 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.408 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 8.0 m -131.88 149.85 74.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 O-C-N 122.621 -0.34 . . . . 2.66 110.698 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -65.84 156.57 63.51 Favored 'Trans proline' 0 N--CA 1.464 -0.206 0 C-N-CA 122.493 2.129 . . . . 2.93 111.626 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.509 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 20.3 ttt -69.82 152.98 43.94 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 121.109 -0.236 . . . . 2.52 110.426 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.9 m120 78.96 -0.19 2.39 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.618 0.767 . . . . 3.65 112.076 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.3 p -83.68 -24.67 31.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.65 0.738 . . . . 2.87 109.131 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -120.61 145.39 47.43 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.911 -1.04 . . . . 2.52 109.836 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HD2' HD11 ' A' ' 65' ' ' LEU . 22.7 ptt-85 -112.33 138.82 48.5 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.043 -0.526 . . . . 3.47 109.787 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.431 ' HB3' HD11 ' A' ' 88' ' ' ILE . 49.2 m-85 -107.0 128.26 54.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.482 -0.562 . . . . 2.4 109.482 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.411 HD11 ' HD2' ' A' ' 63' ' ' ARG . 6.7 mp -116.14 134.42 54.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.226 0.536 . . . . 3.2 112.05 -178.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.403 ' HE1' ' OD1' ' A' ' 86' ' ' ASP . 65.2 t80 -129.63 115.56 17.56 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.354 -0.839 . . . . 2.97 109.016 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.39 26.32 15.71 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.818 -0.628 . . . . 3.64 111.391 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.64 -20.73 49.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.985 -0.626 . . . . 3.75 113.426 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -99.79 138.68 36.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.955 0.377 . . . . 4.67 110.631 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -75.46 135.85 40.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.331 0.586 . . . . 3.55 110.469 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 36.9 mm -71.05 126.44 31.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.327 -0.851 . . . . 2.55 111.86 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.435 ' HB3' ' CD2' ' A' ' 75' ' ' HIS . . . -91.98 162.59 14.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.668 -0.696 . . . . 2.89 109.729 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -72.92 -24.96 60.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.85 0.357 . . . . 2.44 111.406 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -87.95 3.61 48.0 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.86 0.362 . . . . 3.29 110.755 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.435 ' CD2' ' HB3' ' A' ' 72' ' ' ALA . 13.9 m170 -86.48 152.21 22.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.008 0.432 . . . . 3.27 111.013 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 20.6 p -129.97 161.77 57.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.612 -0.722 . . . . 2.53 109.8 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -69.13 -13.22 35.86 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.389 2.059 . . . . 2.21 111.765 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -74.0 -34.6 64.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.764 -0.653 . . . . 2.92 110.418 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.3 pt-20 -91.84 175.88 6.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.43 -0.581 . . . . 3.18 109.43 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.422 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 24.1 mt 72.04 -29.96 0.2 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.091 0.556 . . . . 3.04 111.845 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 95.64 36.82 5.21 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.977 -0.63 . . . . 2.76 112.181 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 50.2 mtp -73.68 131.24 41.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.765 -0.457 . . . . 2.41 109.765 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -125.37 -169.06 1.93 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.741 0.305 . . . . 3.44 111.32 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 22' ' ' ILE . 9.9 tp10 -71.06 142.83 50.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.986 -0.552 . . . . 2.34 110.606 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 59.8 32.25 21.23 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 123.548 0.53 . . . . 2.55 111.223 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.403 ' OD1' ' HE1' ' A' ' 66' ' ' PHE . 1.1 t0 -76.53 171.01 15.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 2.28 110.628 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.6 t -118.08 140.34 41.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.084 0.469 . . . . 2.19 111.707 -178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.1 tt -139.0 127.64 28.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.149 -0.686 . . . . 1.86 109.149 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.418 ' O ' ' HA ' ' A' ' 64' ' ' PHE . 44.5 mt-10 -94.8 149.29 21.4 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.651 0.263 . . . . 2.9 111.564 -178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -130.5 125.66 59.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.131 -0.486 . . . . 2.36 110.241 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -132.56 161.54 33.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.308 -0.405 . . . . 2.94 110.515 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -86.92 130.93 34.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.806 0.336 . . . . 3.63 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.73 140.16 42.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.488 -0.324 . . . . 3.61 110.17 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -56.56 -36.28 69.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.945 -0.57 . . . . 4.92 111.156 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.34 -29.54 70.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.114 -0.494 . . . . 4.41 111.847 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.09 -1.04 86.43 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.06 -0.591 . . . . 3.73 112.586 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.692 -1.06 . . . . 3.68 111.833 179.89 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 46.3 mttm . . . . . 0 N--CA 1.48 1.029 0 CA-C-O 120.752 0.311 . . . . 7.46 110.376 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.665 HG11 ' HA ' ' A' ' 34' ' ' ILE . 3.3 t -117.87 148.11 20.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 109.722 -0.473 . . . . 2.65 109.722 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -69.42 144.5 53.31 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.984 -0.376 . . . . 2.5 109.984 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 35' ' ' HIS . 1.6 t -107.61 118.51 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 N-CA-C 109.759 -0.459 . . . . 2.13 109.759 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.536 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 21.4 mt -68.64 118.47 12.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.725 -0.472 . . . . 1.61 109.725 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -76.51 121.34 22.99 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.871 -0.604 . . . . 2.53 111.31 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.589 HD13 ' HE1' ' A' ' 36' ' ' PHE . 2.2 mp -125.27 22.47 7.81 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.506 0.67 . . . . 1.77 109.4 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' THR . . . . . 0.456 ' HB ' ' CZ ' ' A' ' 21' ' ' TYR . 4.3 t -87.2 -31.14 20.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.172 -0.922 . . . . 3.0 111.735 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 23.3 mm -79.59 79.21 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.384 0.611 . . . . 3.74 110.094 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -92.04 -29.58 16.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.471 -0.786 . . . . 6.22 109.658 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -112.71 91.44 3.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.63 -0.713 . . . . 5.71 109.52 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 65.7 m -56.48 112.39 1.25 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.546 . . . . 6.23 110.961 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -107.93 -16.94 14.18 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.623 -0.717 . . . . 5.9 110.407 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 36.9 t0 . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 108.902 -0.777 . . . . 5.62 108.902 179.716 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE2' ' HB ' ' B' ' 8' ' ' THR . 92.3 m-85 . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 109.663 -0.495 . . . . 2.72 109.663 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.9 mm -92.98 131.61 39.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.059 0.457 . . . . 1.99 111.574 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HB3' ' HZ3' ' A' ' 23' ' ' LYS . 4.3 ttpm? -110.45 118.79 37.2 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.083 -0.508 . . . . 3.07 109.726 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -101.52 150.41 23.09 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.92 -0.582 . . . . 1.36 110.641 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.546 ' HE3' ' NE2' ' A' ' 35' ' ' HIS . 31.9 mtpt -103.42 110.48 22.51 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.411 -0.589 . . . . 2.7 109.411 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.1 t -88.46 125.13 41.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.262 -0.426 . . . . 1.62 110.517 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 32' ' ' SER . 35.2 mm -113.31 123.88 69.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.935 -0.575 . . . . 2.39 110.625 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.38 177.53 40.95 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.937 -0.649 . . . . 2.64 111.874 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -69.5 -27.76 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.571 0.185 . . . . 3.73 111.31 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -88.7 26.5 1.49 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.752 0.31 . . . . 3.07 110.954 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m 61.64 34.77 17.45 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.316 0.579 . . . . 3.25 110.793 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.544 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -84.45 149.02 26.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.764 -0.653 . . . . 2.47 110.343 -179.714 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -131.43 120.04 22.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.183 -0.462 . . . . 2.99 110.192 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.8 mm -131.55 139.47 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.359 -0.608 . . . . 1.81 109.359 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.565 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 20.2 m170 -89.49 140.22 29.75 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.473 -0.566 . . . . 2.04 109.473 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.56 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -127.93 106.55 9.17 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.537 -0.301 . . . . 1.53 111.091 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.441 ' HB2' HG22 ' B' ' 4' ' ' VAL . 5.5 ttmt -79.26 103.49 9.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.116 -0.493 . . . . 2.4 109.714 178.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 m -109.38 159.65 8.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.043 0.449 . . . . 1.57 111.215 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -104.58 126.28 51.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.058 -0.519 . . . . 3.2 109.94 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 57.2 ttp -76.57 84.71 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.102 -0.703 . . . . 3.01 109.102 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.3 m 168.52 -36.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.21 108.132 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.5 m -76.26 145.56 39.59 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.168 -0.924 . . . . 1.75 110.603 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -69.76 148.52 49.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.398 -0.365 . . . . 2.43 110.723 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.654 ' HA ' HD23 ' A' ' 47' ' ' LEU . 97.1 mt -66.36 -15.07 62.99 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 1.89 111.329 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 8.6 tptt -60.03 -39.55 86.26 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.528 -0.545 . . . . 2.44 109.528 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -61.45 -42.62 99.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.195 -0.911 . . . . 2.08 110.683 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 44' ' ' LEU . 1.8 mm? -66.49 -40.9 89.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.947 -0.569 . . . . 2.54 110.49 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -64.15 -51.07 65.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 2.26 112.251 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -63.08 -47.69 81.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.269 0.47 . . . . 1.88 112.269 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.584 ' CB ' HD21 ' B' ' 7' ' ' LEU . 67.9 m -65.13 -32.48 74.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.818 0.303 . . . . 1.46 111.818 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.06 -40.21 90.71 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.018 -0.734 . . . . 1.69 109.018 179.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 74.4 m -64.39 -38.05 89.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.647 -0.706 . . . . 1.99 109.493 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.523 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 91.1 mt-30 -64.12 -41.39 97.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.772 -0.649 . . . . 2.17 110.281 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.44 ' NH1' HG12 ' B' ' 5' ' ' ILE . 26.9 ttt180 -67.65 -38.76 84.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.463 -0.335 . . . . 2.17 111.012 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -79.58 -9.92 59.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.53 -0.305 . . . . 2.41 111.293 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.09 36.97 56.23 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 121.111 -0.566 . . . . 2.74 112.496 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.74 151.55 71.03 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 110.482 -0.192 . . . . 2.66 110.482 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -67.07 157.91 59.44 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.844 2.363 . . . . 2.93 111.729 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.471 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 16.3 tpt -64.13 143.31 57.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.543 -0.299 . . . . 2.52 111.055 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 59' ' ' MET . 5.0 m120 75.48 1.4 3.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.057 0.762 . . . . 3.65 113.057 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.4 p -74.71 -26.48 59.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.238 0.542 . . . . 2.87 109.683 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 44.6 mt -119.11 150.11 40.56 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.386 -0.825 . . . . 2.52 110.148 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.0 ptt-85 -113.06 142.13 46.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.005 -0.543 . . . . 3.47 109.658 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.402 ' HB3' HD11 ' A' ' 88' ' ' ILE . 80.6 m-85 -108.48 114.4 28.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.214 -0.448 . . . . 2.4 109.805 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.6 mt -106.39 123.58 48.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.116 0.484 . . . . 3.2 111.406 -178.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -124.5 111.43 15.69 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.679 -0.691 . . . . 2.97 109.281 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 61.86 24.56 14.64 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.094 -0.503 . . . . 3.64 111.347 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.68 73.56 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.551 -0.833 . . . . 3.75 112.401 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -105.41 134.13 49.03 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.786 -0.449 . . . . 4.67 109.786 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.09 131.2 37.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.325 0.584 . . . . 3.55 110.025 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.2 mm -68.24 111.47 2.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.536 -0.756 . . . . 2.55 111.356 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.51 157.11 24.95 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.144 -0.48 . . . . 2.89 110.348 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.415 ' CG ' ' HD3' ' A' ' 45' ' ' LYS . 85.3 m-20 -67.24 -26.34 66.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.114 -0.494 . . . . 2.44 111.491 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -93.73 11.81 27.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.348 -0.387 . . . . 3.29 111.46 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.432 ' HB3' HD12 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -91.49 157.02 17.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.123 0.487 . . . . 3.27 110.832 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.576 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -137.48 157.76 73.32 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 2.53 110.256 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.91 -19.35 61.99 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.696 2.264 . . . . 2.21 112.636 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -64.63 -35.94 82.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.905 0.383 . . . . 2.92 110.888 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.5 pt-20 -94.99 176.88 6.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 3.18 110.295 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 81.3 mt 70.13 -9.37 0.74 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.071 0.548 . . . . 3.04 111.906 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 71.1 44.42 54.25 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.923 -0.656 . . . . 2.76 111.99 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -70.56 138.62 51.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.505 0.193 . . . . 2.41 110.628 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.527 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 42.0 mt-10 -127.42 170.12 12.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.797 0.332 . . . . 3.44 110.619 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 20.8 tp10 -69.47 140.9 54.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.912 -0.586 . . . . 2.34 109.473 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 31.5 mm-40 70.11 19.87 6.59 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.526 0.516 . . . . 2.55 111.261 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.7 OUTLIER -73.82 160.94 30.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.975 -0.38 . . . . 2.28 109.975 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 82.5 t -108.44 131.35 59.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.045 0.45 . . . . 2.19 111.99 -178.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' A' ' 64' ' ' PHE . 17.2 tt -126.0 131.69 71.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.669 -0.863 . . . . 1.86 108.669 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -102.88 137.54 40.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.813 0.339 . . . . 2.9 111.7 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 5.4 p -121.2 126.61 75.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 2.36 110.295 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -132.64 160.87 35.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.638 0.256 . . . . 2.94 111.081 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -81.07 135.53 35.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.264 -0.425 . . . . 3.63 110.948 -179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -84.08 148.11 27.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.229 -0.441 . . . . 3.61 109.952 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -66.94 -25.92 66.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.423 -0.353 . . . . 4.92 111.655 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.27 -33.19 65.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.713 0.292 . . . . 4.41 111.455 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.79 5.73 87.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.766 -0.73 . . . . 3.73 112.024 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.868 0 CA-C-O 118.875 -0.958 . . . . 3.68 111.91 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.587 0.232 . . . . 7.46 110.602 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.9 m -76.4 150.01 6.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.11 -0.495 . . . . 2.65 110.147 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -66.9 138.95 57.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.075 -0.511 . . . . 2.5 111.167 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 10.4 p -105.57 124.95 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-O 121.279 0.561 . . . . 2.13 110.382 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.56 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 5.7 mt -76.38 119.36 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 109.426 -0.583 . . . . 1.61 109.426 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -83.54 105.93 14.86 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 120.676 0.274 . . . . 2.53 110.617 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.584 HD21 ' CB ' ' A' ' 50' ' ' SER . 0.4 OUTLIER -134.17 23.38 3.82 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.138 0.494 . . . . 1.77 110.657 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 8' ' ' THR . . . . . 0.606 ' HB ' ' CE2' ' A' ' 21' ' ' TYR . 73.1 p -77.18 55.25 1.16 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.846 -0.616 . . . . 3.0 111.096 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ILE . . . . . 0.488 HD12 ' O ' ' B' ' 11' ' ' SER . 2.7 pt -129.91 -173.06 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.022 -0.535 . . . . 3.74 110.926 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -100.01 -53.46 3.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.055 -0.52 . . . . 6.22 110.816 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' SER . . . . . 0.488 ' O ' HD12 ' B' ' 9' ' ' ILE . 1.9 p -117.02 162.74 17.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.526 -0.761 . . . . 5.71 110.787 -179.01 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 18.5 m -62.8 -49.62 74.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.232 0.539 . . . . 6.23 109.84 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.61 58.55 4.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.465 -0.789 . . . . 5.9 109.675 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.742 -0.663 . . . . 5.62 111.279 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 N--CA 1.481 1.111 0 N-CA-C 109.949 -0.389 . . . . 2.72 109.949 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.1 mm -84.53 118.58 31.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 109.428 -0.582 . . . . 1.99 109.428 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -93.47 118.66 31.6 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.063 0.459 . . . . 3.07 110.938 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 94.0 mt -104.49 150.61 24.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.717 -0.674 . . . . 1.36 109.691 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -113.65 113.22 24.73 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.031 0.443 . . . . 2.7 111.592 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.439 HG22 ' CG2' ' A' ' 88' ' ' ILE . 60.4 t -96.44 119.37 44.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.22 -0.659 . . . . 1.62 109.22 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.524 ' HA ' ' O ' ' A' ' 32' ' ' SER . 25.1 mm -100.62 120.39 50.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 2.39 111.555 -178.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.61 171.0 42.92 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.263 -0.735 . . . . 2.64 111.263 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.5 tp60 -69.58 -22.82 63.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.126 0.489 . . . . 3.73 110.867 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -85.85 15.26 5.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.977 -0.556 . . . . 3.07 110.995 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 65.51 47.31 2.28 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.231 0.539 . . . . 3.25 111.43 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.524 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 13.3 p -111.6 136.06 51.33 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.351 -0.611 . . . . 2.47 109.351 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -115.6 94.96 4.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.992 0.425 . . . . 2.99 110.559 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.5 mt -91.07 138.56 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.166 -0.47 . . . . 1.81 110.235 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.649 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 33.4 m80 -92.12 138.74 31.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.88 -0.6 . . . . 2.04 111.775 -178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.421 ' HZ ' ' CD1' ' A' ' 51' ' ' TYR . 4.4 m-85 -126.17 106.69 9.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.795 -0.639 . . . . 1.53 109.995 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.597 ' HE2' HG21 ' B' ' 4' ' ' VAL . 23.9 mtmt -85.29 96.84 9.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.217 0.532 . . . . 2.4 110.89 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.8 m -106.58 171.2 2.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.761 -0.654 . . . . 1.57 110.785 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -128.06 141.17 51.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.32 -0.622 . . . . 3.2 109.32 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 ttp -77.64 84.9 3.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.387 0.613 . . . . 3.01 109.789 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 48.3 m -164.88 -51.59 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.92 -1.036 . . . . 2.21 108.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.34 148.61 32.01 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.825 -1.079 . . . . 1.75 110.313 179.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -67.4 159.16 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.258 -0.428 . . . . 2.43 110.616 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.9 mt -69.29 -11.88 61.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.249 0.547 . . . . 1.89 109.71 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.46 72.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.198 -0.91 . . . . 2.44 109.216 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.5 tptt -60.31 -43.42 96.34 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.102 -0.954 . . . . 2.08 110.928 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.471 ' HA ' HD13 ' B' ' 7' ' ' LEU . 3.8 tt -64.8 -33.48 76.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.063 0.458 . . . . 2.54 111.044 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -74.45 -36.7 63.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 2.26 112.002 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 0.1 OUTLIER -82.24 -45.82 14.53 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.61 0.596 . . . . 1.88 112.61 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 p -58.8 -45.53 89.66 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.328 0.492 . . . . 1.46 112.328 -178.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.421 ' CD1' ' HZ ' ' A' ' 36' ' ' PHE . 6.9 t80 -64.33 -36.2 83.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.72 -0.392 . . . . 1.69 111.39 -179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.7 m -61.22 -39.42 90.19 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.091 0.472 . . . . 1.99 109.948 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -63.88 -44.28 93.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.744 . . . . 2.17 110.391 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.429 HH12 ' HB2' ' B' ' 3' ' ' ASP . 16.5 ttt180 -65.72 -42.21 91.34 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.973 -0.558 . . . . 2.17 110.837 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -69.2 -26.86 65.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.506 -0.315 . . . . 2.41 110.903 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.61 33.18 10.4 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.8 -0.714 . . . . 2.74 111.84 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 m -133.01 154.3 81.3 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.745 0.307 . . . . 2.66 110.5 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.69 149.86 73.82 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.56 2.173 . . . . 2.93 111.722 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.525 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 23.1 ttt -68.64 161.66 27.65 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.504 -0.317 . . . . 2.52 110.242 179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 59' ' ' MET . 11.3 m120 78.53 -12.09 1.13 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.512 0.725 . . . . 3.65 111.589 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -78.3 -31.24 48.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.341 0.591 . . . . 2.87 109.515 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -108.84 131.66 54.77 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.438 -0.801 . . . . 2.52 110.1 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptt-85 -107.99 122.92 47.84 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 3.47 110.086 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -88.3 125.11 34.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.964 -0.562 . . . . 2.4 109.696 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.4 mt -110.06 131.64 54.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.986 -0.552 . . . . 3.2 110.862 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -124.81 106.34 9.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.621 -0.718 . . . . 2.97 109.291 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 64.35 33.2 11.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 3.64 111.054 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.83 -21.07 45.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.815 -0.707 . . . . 3.75 113.895 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -103.2 138.71 39.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.263 0.531 . . . . 4.67 110.565 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -70.47 148.42 48.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.297 0.57 . . . . 3.55 111.061 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 29.5 mm -85.22 120.88 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.427 -0.806 . . . . 2.55 111.533 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.87 156.52 24.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.962 -0.563 . . . . 2.89 109.913 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -70.08 -27.03 64.29 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.267 -0.424 . . . . 2.44 111.598 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -87.63 1.23 54.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.309 -0.405 . . . . 3.29 111.234 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.7 m170 -85.16 144.92 27.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.045 0.45 . . . . 3.27 110.858 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.483 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 41.8 p -120.99 161.63 39.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.709 -0.678 . . . . 2.53 109.926 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.81 -3.08 7.5 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.666 2.244 . . . . 2.21 112.479 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -79.64 -35.5 39.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.955 -0.566 . . . . 2.92 110.37 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 76' ' ' THR . 2.9 pt-20 -94.54 -179.57 4.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.185 -0.462 . . . . 3.18 109.992 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.6 mt 73.05 -29.54 0.2 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.327 0.651 . . . . 3.04 111.776 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 94.06 34.58 6.4 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.363 -0.695 . . . . 2.76 111.363 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.2 ttm -65.7 128.76 37.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 2.41 110.974 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -121.46 -177.65 3.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.987 -0.551 . . . . 3.44 110.635 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -75.59 144.52 41.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.149 -0.478 . . . . 2.34 110.275 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 62.1 27.05 16.31 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.582 0.551 . . . . 2.55 110.584 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.68 140.64 40.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.544 . . . . 2.28 110.602 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.403 HG13 HG12 ' A' ' 27' ' ' ILE . 54.8 t -90.38 127.28 42.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.708 -0.678 . . . . 2.19 111.631 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.439 ' CG2' HG22 ' A' ' 26' ' ' VAL . 19.3 tt -125.68 139.97 49.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.61 -0.885 . . . . 1.86 108.61 178.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -104.86 157.99 16.83 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.992 0.425 . . . . 2.9 111.444 -178.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 p -141.19 121.91 12.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 2.36 110.418 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -128.55 161.7 28.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.029 -0.532 . . . . 2.94 109.711 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -92.42 138.41 31.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 3.63 110.955 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -72.36 142.67 48.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.892 -0.595 . . . . 3.61 110.019 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -66.98 -34.41 77.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.393 -0.367 . . . . 4.92 110.597 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -35.52 80.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.019 -0.537 . . . . 4.41 111.408 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.24 -27.68 15.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.842 -0.694 . . . . 3.73 111.902 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.874 0 CA-C-O 118.88 -0.955 . . . . 3.68 111.749 179.745 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 84.6 mttt . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 110.026 -0.361 . . . . 7.46 110.026 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.0 m -102.3 145.94 11.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.818 0.342 . . . . 2.65 110.594 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.429 ' HB2' HH12 ' A' ' 54' ' ' ARG . 13.8 m-20 -77.61 115.34 17.29 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.496 -0.557 . . . . 2.5 109.496 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.649 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 7.4 p -84.85 121.62 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.89 0 N-CA-C 109.278 -0.638 . . . . 2.13 109.278 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -90.58 109.61 21.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.829 -0.623 . . . . 1.61 110.757 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ASP . . . . . 0.41 ' HA ' ' O ' ' A' ' 37' ' ' LYS . 1.8 m-20 -76.46 117.95 18.64 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 116.058 -0.519 . . . . 2.53 109.757 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 47' ' ' LEU . 13.1 mt -123.33 36.98 4.52 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.45 0.643 . . . . 1.77 110.033 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 3.4 t -69.21 -19.5 63.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.307 -0.86 . . . . 3.0 111.563 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 2.0 pt -124.88 154.55 32.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.448 -0.342 . . . . 3.74 110.96 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.415 ' OE2' ' HD3' ' A' ' 46' ' ' LYS . 11.8 tp10 -76.32 -36.36 58.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.471 0.653 . . . . 6.22 109.549 179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 5.6 m -124.38 127.3 47.36 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.778 -0.647 . . . . 5.71 110.086 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 9.7 m -53.94 121.02 7.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.074 0.464 . . . . 6.23 110.786 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.6 m -116.13 22.08 13.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.104 0.478 . . . . 5.9 110.689 -179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 1.2 t70 . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.856 -0.611 . . . . 5.62 109.608 179.861 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.576 ' CE2' ' HB ' ' B' ' 8' ' ' THR . 95.8 m-85 . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 110.001 -0.37 . . . . 2.72 110.001 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.3 mm -74.64 129.52 36.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 116.464 -0.334 . . . . 1.99 110.118 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 tttt -103.39 119.76 39.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.164 0.507 . . . . 3.07 111.364 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.0 mt -106.33 150.25 26.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.561 -0.745 . . . . 1.36 109.537 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -104.74 106.57 17.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.432 -0.349 . . . . 2.7 110.581 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.01 123.02 37.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.202 -0.666 . . . . 1.62 109.202 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 89' ' ' GLU . 48.1 mm -117.92 108.57 24.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.013 0.435 . . . . 2.39 110.625 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.28 170.13 50.42 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.582 -0.818 . . . . 2.64 111.29 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -64.99 -27.69 69.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.14 0.495 . . . . 3.73 110.731 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.15 25.41 1.87 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.686 -0.688 . . . . 3.07 111.411 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.8 m 60.11 33.84 21.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.167 0.508 . . . . 3.25 111.839 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.42 114.11 23.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.991 -0.55 . . . . 2.47 109.739 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.646 ' O ' HG11 ' B' ' 2' ' ' VAL . 3.7 mt-10 -101.37 108.75 20.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.609 -0.515 . . . . 2.99 109.609 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.652 ' HA ' HG11 ' B' ' 2' ' ' VAL . 7.8 mm -115.66 144.43 23.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.567 0.223 . . . . 1.81 110.41 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -89.06 141.78 28.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.916 0.389 . . . . 2.04 110.391 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.491 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -133.79 104.41 6.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 1.53 111.063 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.404 ' CE ' HG11 ' B' ' 4' ' ' VAL . 4.7 mtmt -91.01 106.75 18.74 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.254 0.55 . . . . 2.4 110.982 178.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.45 HG11 HD23 ' A' ' 47' ' ' LEU . 18.0 m -111.83 170.46 3.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.689 -0.687 . . . . 1.57 111.249 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.483 ' HE2' ' OG1' ' A' ' 42' ' ' THR . 16.1 pttm -119.16 138.67 52.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.989 -0.55 . . . . 3.2 109.922 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 42.7 tpp -75.1 84.71 2.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.125 0.488 . . . . 3.01 110.141 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.3 -55.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 2.21 109.369 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.483 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 0.8 OUTLIER -79.09 147.64 32.7 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.126 -0.943 . . . . 1.75 110.841 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -70.19 173.51 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.236 -0.653 . . . . 2.43 109.236 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.01 3.89 6.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.246 0.546 . . . . 1.89 110.139 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.4 tptt -60.24 -46.2 90.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.102 -0.953 . . . . 2.44 109.208 177.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -65.24 -38.48 90.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.888 -1.051 . . . . 2.08 110.037 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.45 HD23 HG11 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -53.93 -46.15 71.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.815 -0.63 . . . . 2.54 110.581 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 53.7 mtpt -70.05 -54.67 12.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.725 -0.67 . . . . 2.26 112.647 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -43.62 79.79 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.198 0.814 . . . . 1.88 113.198 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.8 m -63.47 -37.1 86.0 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.327 -0.233 . . . . 1.46 111.537 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -67.17 -43.68 81.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.636 -0.426 . . . . 1.69 109.915 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.66 -37.65 82.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.01 0.433 . . . . 1.99 110.303 179.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -60.39 -43.08 96.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.825 -0.625 . . . . 2.17 110.518 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.18 -28.78 61.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.326 -0.397 . . . . 2.17 110.888 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -74.92 -19.68 60.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.511 -0.313 . . . . 2.41 111.184 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.64 25.38 42.5 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.609 -0.805 . . . . 2.74 112.288 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 7.0 m -127.73 154.7 77.91 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 110.07 -0.345 . . . . 2.66 110.07 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.38 161.91 44.28 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.283 1.988 . . . . 2.93 111.771 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.06 153.36 43.9 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.292 -0.413 . . . . 2.52 110.664 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t30 74.96 5.97 4.32 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.612 0.765 . . . . 3.65 112.069 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.5 p -88.81 -26.01 21.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.263 0.554 . . . . 2.87 109.698 178.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -115.5 146.22 41.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.47 -0.786 . . . . 2.52 110.24 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.5 ptt-85 -119.0 133.99 55.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.401 -0.592 . . . . 3.47 109.401 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 96.2 m-85 -102.65 128.05 49.5 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.069 -0.514 . . . . 2.4 109.906 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.9 mt -110.35 133.45 53.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.378 0.609 . . . . 3.2 111.546 -179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -124.95 105.55 9.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.106 -0.952 . . . . 2.97 108.508 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 63.95 22.68 13.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.862 -0.608 . . . . 3.64 110.87 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.17 -25.75 26.13 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.973 -0.632 . . . . 3.75 112.678 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -87.36 143.07 27.43 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.099 -0.334 . . . . 4.67 110.099 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -82.16 140.33 33.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.257 0.551 . . . . 3.55 110.706 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.6 mm -78.56 116.14 21.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.559 -0.746 . . . . 2.55 111.082 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.57 26.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.016 -0.538 . . . . 2.89 110.39 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.426 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.1 m-20 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.227 -0.442 . . . . 2.44 111.222 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -92.21 -2.52 56.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.498 -0.319 . . . . 3.29 111.68 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.2 m170 -67.35 143.89 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.765 0.317 . . . . 3.27 110.877 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 75.6 p -120.27 155.84 55.67 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 116.307 -0.406 . . . . 2.53 110.615 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.01 -11.05 28.69 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.39 2.06 . . . . 2.21 111.212 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -78.89 -38.92 36.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.504 -0.771 . . . . 2.92 110.274 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 10.0 pt-20 -86.49 -179.15 6.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.462 -0.335 . . . . 3.18 110.41 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 9.0 mt 72.07 -54.75 0.68 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.225 0.61 . . . . 3.04 111.674 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.85 36.36 0.67 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.673 -0.571 . . . . 2.76 111.673 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.07 132.37 45.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.9 0.381 . . . . 2.41 110.453 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -124.79 -168.74 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.12 0.486 . . . . 3.44 111.485 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -76.24 143.76 40.79 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.518 -0.764 . . . . 2.34 109.681 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 60.59 28.12 17.81 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.421 . . . . 2.55 110.893 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.92 147.15 43.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 2.28 110.153 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 17.6 t -96.09 128.32 47.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.234 0.54 . . . . 2.19 111.708 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.8 tt -125.57 112.81 32.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.742 -0.836 . . . . 1.86 108.742 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 27' ' ' ILE . 75.8 mt-10 -88.64 141.45 28.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.736 -0.666 . . . . 2.9 111.181 -178.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.41 137.52 53.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.075 -0.511 . . . . 2.36 110.349 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -137.12 163.36 31.01 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.557 -0.534 . . . . 2.94 109.557 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -95.81 139.43 32.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.686 0.279 . . . . 3.63 110.48 -179.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -79.17 149.34 32.01 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 3.61 110.289 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -58.59 -45.5 88.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 4.92 110.841 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.7 p -72.05 -32.75 67.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.056 -0.52 . . . . 4.41 110.277 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.73 15.04 70.78 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.682 -0.69 . . . . 3.73 112.296 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.936 0 N-CA-C 110.922 -0.871 . . . . 3.68 110.922 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 110.182 -0.303 . . . . 7.46 110.182 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.652 HG11 ' HA ' ' A' ' 34' ' ' ILE . 12.0 t -77.01 150.2 6.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.213 -0.449 . . . . 2.65 110.273 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -67.47 138.04 56.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.03 -0.532 . . . . 2.5 110.243 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.404 HG11 ' CE ' ' A' ' 37' ' ' LYS . 15.0 p -106.17 127.59 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-O 121.433 0.635 . . . . 2.13 110.94 -179.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.491 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 18.4 mt -87.55 108.52 18.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.828 -0.624 . . . . 1.61 109.502 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ASP . . . . . 0.422 ' O ' HD23 ' B' ' 7' ' ' LEU . 22.8 m-20 -79.67 134.42 36.42 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.79 -0.448 . . . . 2.53 109.79 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.422 HD23 ' O ' ' B' ' 6' ' ' ASP . 18.2 mt -119.35 27.25 8.91 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.479 0.657 . . . . 1.77 109.989 178.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' THR . . . . . 0.576 ' HB ' ' CE2' ' A' ' 21' ' ' TYR . 1.4 t -74.9 -41.25 60.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.489 -0.778 . . . . 3.0 110.545 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 39.1 mm -66.47 116.6 5.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.086 -0.506 . . . . 3.74 111.398 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -144.24 -67.43 0.33 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.684 -0.689 . . . . 6.22 110.054 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 14.3 m -107.62 153.67 22.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.931 -0.577 . . . . 5.71 109.722 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 41.8 m -55.37 108.22 0.4 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 6.23 111.189 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 4.4 p -165.53 -23.62 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.79 -0.641 . . . . 5.9 111.762 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 19.0 t70 . . . . . 0 N--CA 1.463 0.216 0 C-N-CA 120.9 -0.32 . . . . 5.62 110.975 -179.583 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' OH ' ' HA ' ' B' ' 10' ' ' GLU . 9.1 m-85 . . . . . 0 N--CA 1.48 1.056 0 N-CA-C 110.096 -0.335 . . . . 2.72 110.096 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.9 mm -73.68 128.96 36.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.149 -0.478 . . . . 1.99 109.994 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 35.6 ttpt -112.43 118.59 35.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.442 -0.345 . . . . 3.07 110.204 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.3 mt -102.67 150.29 23.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.334 -0.394 . . . . 1.36 110.039 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -107.82 111.45 23.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.782 0.325 . . . . 2.7 111.173 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 20.2 t -90.06 104.35 15.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.129 -0.693 . . . . 1.62 109.129 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.76 114.93 30.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.066 0.46 . . . . 2.39 111.47 -178.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 170.05 34.56 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.771 -0.65 . . . . 2.64 111.949 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -71.85 -16.59 62.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.135 0.493 . . . . 3.73 110.9 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -91.69 15.03 13.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.486 . . . . 3.07 110.747 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.9 m 68.14 30.17 5.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.582 -0.735 . . . . 3.25 111.708 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 55.7 p -99.18 140.69 32.96 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.494 -0.558 . . . . 2.47 109.494 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.429 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 5.0 pt-20 -125.71 92.57 3.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.133 0.492 . . . . 2.99 110.939 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.76 HD13 HG11 ' B' ' 2' ' ' VAL . 6.6 mm -81.22 139.3 18.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.767 -0.827 . . . . 1.81 108.767 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.414 ' HB3' HG13 ' B' ' 4' ' ' VAL . 2.2 m-70 -95.64 147.61 23.4 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.871 -0.332 . . . . 2.04 110.32 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.602 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -125.62 117.11 22.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.324 -0.398 . . . . 1.53 111.164 -179.32 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.46 ' N ' HG12 ' B' ' 4' ' ' VAL . 3.6 mtmt -96.68 96.11 8.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.136 0.493 . . . . 2.4 110.818 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.447 HG12 ' HB2' ' B' ' 7' ' ' LEU . 16.2 m -118.29 170.88 7.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.733 . . . . 1.57 111.35 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.89 147.0 50.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.932 -0.766 . . . . 3.2 108.932 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.654 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 23.1 mmt -69.39 86.2 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.209 0.528 . . . . 3.01 110.672 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.1 m -164.53 -52.32 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.529 -0.76 . . . . 2.21 109.622 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.05 147.66 34.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.261 -0.881 . . . . 1.75 111.484 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -69.37 165.58 20.46 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.154 -0.475 . . . . 2.43 110.586 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.483 HD13 HD12 ' A' ' 71' ' ' ILE . 53.2 mt -70.99 -9.92 58.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.149 0.499 . . . . 1.89 110.564 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG3' ' OD2' ' A' ' 73' ' ' ASP . 40.3 tttp -63.49 -38.01 89.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.236 -0.653 . . . . 2.44 109.236 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -61.76 -36.38 80.87 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.316 -0.857 . . . . 2.08 110.218 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.21 -39.52 94.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.603 -0.726 . . . . 2.54 110.391 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -70.6 -52.45 21.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.38 -0.827 . . . . 2.26 112.206 -178.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.476 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 4.4 pt-20 -65.27 -47.04 78.08 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.884 0.698 . . . . 1.88 112.884 -177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.462 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 13.0 m -59.79 -39.26 84.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.711 0.291 . . . . 1.46 111.777 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.407 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 21.3 t80 -69.28 -41.06 77.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.632 -0.427 . . . . 1.69 110.298 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.72 -40.78 96.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.327 -0.397 . . . . 1.99 110.634 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 92.9 mt-30 -62.07 -41.78 98.52 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.226 0.536 . . . . 2.17 109.955 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.457 ' NH1' HG12 ' B' ' 5' ' ' ILE . 23.4 ttt180 -64.86 -43.81 91.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.846 -0.615 . . . . 2.17 110.573 179.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 13.5 mm100 -69.39 -25.33 64.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 2.41 110.466 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.71 40.36 8.28 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 111.224 -0.75 . . . . 2.74 111.224 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.4 m -135.99 155.75 77.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.292 . . . . 2.66 110.21 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.45 148.46 92.62 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.87 2.38 . . . . 2.93 112.126 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.476 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 12.6 ttt -76.44 61.32 1.7 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.498 0.666 . . . . 2.52 110.883 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.419 ' H ' ' H ' ' A' ' 61' ' ' SER . 64.0 t30 -170.1 -18.36 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.446 -0.797 . . . . 3.65 109.735 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.419 ' H ' ' H ' ' A' ' 60' ' ' ASN . 1.4 m -82.31 -12.05 58.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 2.87 111.583 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 64.2 mt -121.64 139.32 53.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.05 0.453 . . . . 2.52 111.177 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.406 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 19.9 ptt-85 -118.15 129.0 55.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.993 -0.549 . . . . 3.47 109.565 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -97.68 126.98 43.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.982 -0.553 . . . . 2.4 110.309 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 81.9 mt -113.88 137.12 52.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 3.2 110.851 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -127.17 100.38 6.07 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.495 -0.928 . . . . 2.97 108.495 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 65.55 31.79 9.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.634 -0.712 . . . . 3.64 110.555 -179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.74 -28.04 15.24 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.733 -0.667 . . . . 3.75 112.701 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -87.71 135.4 33.39 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.225 -0.287 . . . . 4.67 110.225 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -75.56 142.16 42.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.469 0.652 . . . . 3.55 111.328 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.483 HD12 HD13 ' A' ' 44' ' ' LEU . 30.3 mm -79.59 117.38 25.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.268 -0.878 . . . . 2.55 110.925 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.45 ' HB3' ' ND1' ' A' ' 75' ' ' HIS . . . -84.81 154.9 22.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.048 -0.524 . . . . 2.89 110.229 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.412 ' OD2' ' HG3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -66.99 -27.75 67.69 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.993 -0.548 . . . . 2.44 111.744 -179.051 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -89.4 4.25 49.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 3.29 111.503 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.45 ' ND1' ' HB3' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -86.37 149.16 25.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.336 0.589 . . . . 3.27 111.378 -179.35 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.1 p -117.42 157.95 46.11 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.502 -0.772 . . . . 2.53 110.09 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.654 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 17.0 Cg_exo -67.0 -10.71 29.54 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.441 2.094 . . . . 2.21 111.952 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -79.46 -17.56 53.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.366 0.603 . . . . 2.92 109.79 179.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -98.01 164.14 12.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.661 -0.699 . . . . 3.18 110.26 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 86.6 mt 68.68 -1.13 2.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.888 -0.597 . . . . 3.04 111.944 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.07 45.53 55.96 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.81 -0.71 . . . . 2.76 112.868 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 3.6 ttt -72.53 125.4 27.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.811 0.338 . . . . 2.41 110.229 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -114.18 -171.53 1.93 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.467 0.543 . . . . 3.44 112.467 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.94 137.45 45.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.499 -0.773 . . . . 2.34 110.229 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 54.76 38.7 30.61 Favored 'General case' 0 CA--C 1.516 -0.348 0 O-C-N 123.797 0.686 . . . . 2.55 110.863 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.02 160.11 33.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.609 -0.723 . . . . 2.28 110.404 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 99.3 t -99.16 114.06 35.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.394 0.616 . . . . 2.19 112.208 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -120.32 132.31 70.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 108.277 -1.008 . . . . 1.86 108.277 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -111.66 144.05 41.57 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.916 0.389 . . . . 2.9 111.28 -178.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.62 129.54 73.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.078 -0.51 . . . . 2.36 110.421 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -130.92 159.72 36.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.23 -0.441 . . . . 2.94 110.121 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -79.95 139.59 37.0 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.864 0.364 . . . . 3.63 111.026 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.406 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.4 mm-40 -77.38 149.83 35.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.914 -0.585 . . . . 3.61 110.855 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -73.17 -32.68 64.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.874 -0.603 . . . . 4.92 110.317 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 p -65.18 -57.18 9.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.908 -0.587 . . . . 4.41 110.128 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.35 -20.31 18.82 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.756 -0.656 . . . . 3.73 112.493 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.75 -1.028 . . . . 3.68 111.807 -179.904 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.748 0.309 . . . . 7.46 110.424 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.76 HG11 HD13 ' A' ' 34' ' ' ILE . 46.5 t -76.85 149.26 6.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.238 -0.437 . . . . 2.65 110.655 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.61 148.28 51.61 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.803 -0.635 . . . . 2.5 111.426 -179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.46 HG12 ' N ' ' A' ' 37' ' ' LYS . 2.2 t -99.16 120.12 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-N 115.517 -0.765 . . . . 2.13 109.671 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.483 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 9.6 mt -71.77 108.71 3.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 1.61 109.707 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -73.94 107.6 6.26 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 116.157 -0.474 . . . . 2.53 110.466 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.447 ' HB2' HG12 ' A' ' 38' ' ' VAL . 12.0 mt -100.88 -20.03 15.66 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 119.455 -0.898 . . . . 1.77 109.966 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 1.7 m -122.62 124.31 43.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.767 -0.651 . . . . 3.0 110.343 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 7.6 tp -74.58 147.36 8.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.958 -0.565 . . . . 3.74 110.889 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.501 ' HA ' ' OH ' ' A' ' 21' ' ' TYR . 42.6 mt-10 -81.28 -51.66 8.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.992 0.425 . . . . 6.22 110.72 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.28 162.06 28.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.826 -0.625 . . . . 5.71 110.867 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.95 -52.41 4.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.773 0.32 . . . . 6.23 111.377 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 5.4 m -88.32 -28.61 20.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.486 -0.324 . . . . 5.9 111.251 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 t70 . . . . . 0 C--N 1.324 -0.543 0 CA-C-O 120.929 0.395 . . . . 5.62 110.223 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.464 ' CD1' HG21 ' B' ' 8' ' ' THR . 9.6 m-85 . . . . . 0 N--CA 1.483 1.216 0 N-CA-C 110.09 -0.337 . . . . 2.72 110.09 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm -95.27 131.57 41.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.622 -0.51 . . . . 1.99 109.622 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.712 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -102.5 145.84 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.157 0.503 . . . . 3.07 111.689 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.0 mt -131.0 128.86 41.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.493 -0.776 . . . . 1.36 109.26 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -93.78 109.91 21.57 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.847 0.356 . . . . 2.7 110.464 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 12.4 t -85.55 123.2 39.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.62 110.747 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.6 mm -109.93 116.7 52.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.685 -0.689 . . . . 2.39 110.117 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.65 -179.93 43.33 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 2.64 112.275 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -65.88 -28.48 68.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 3.73 110.617 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -86.21 13.56 7.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.107 -0.497 . . . . 3.07 110.606 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m 59.78 48.63 8.93 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.833 0.825 . . . . 3.25 110.327 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.57 166.42 16.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.954 -1.021 . . . . 2.47 109.815 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' B' ' 2' ' ' VAL . 8.9 tt0 -137.53 97.07 3.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.023 0.44 . . . . 2.99 110.243 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.7 mm -116.23 127.63 73.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.554 . . . . 1.81 109.58 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.644 ' HB3' HG13 ' B' ' 4' ' ' VAL . 0.0 OUTLIER -88.81 166.67 13.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.141 0.495 . . . . 2.04 110.826 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.712 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -143.39 131.11 21.36 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 122.246 -0.284 . . . . 1.53 111.71 -179.062 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -99.09 95.2 6.96 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.061 -0.348 . . . . 2.4 110.061 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.9 m -117.35 171.58 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 1.57 111.465 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.63 148.35 50.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.542 -0.54 . . . . 3.2 109.542 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 mtt -83.96 85.33 7.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.225 0.536 . . . . 3.01 111.032 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 16.3 m -167.74 -46.9 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.294 -1.002 . . . . 2.21 108.294 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.52 148.07 37.35 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.716 -1.129 . . . . 1.75 110.882 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.431 ' HA ' HG22 ' A' ' 76' ' ' THR . 1.4 m-70 -66.67 155.27 38.43 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.295 -0.412 . . . . 2.43 110.648 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.8 mt -69.5 -9.96 56.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.449 . . . . 1.89 110.3 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.553 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 17.8 ttpp -61.51 -40.23 93.87 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.486 -0.779 . . . . 2.44 109.103 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.3 tptp -62.6 -39.87 95.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.349 -0.841 . . . . 2.08 109.95 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.13 -44.39 87.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 2.54 110.201 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -68.88 -54.59 14.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.604 -0.726 . . . . 2.26 112.356 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.4 pt-20 -62.67 -42.58 99.69 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.788 0.662 . . . . 1.88 112.788 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.501 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 9.4 m -65.67 -34.54 78.45 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.816 -0.354 . . . . 1.46 111.22 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.49 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 7.0 t80 -70.87 -40.69 72.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.525 -0.546 . . . . 1.69 109.525 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 79.8 m -61.5 -35.22 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 1.99 109.896 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.501 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 72.8 mt-30 -63.44 -38.12 89.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.69 -0.686 . . . . 2.17 110.363 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.445 ' NH1' HG12 ' B' ' 5' ' ' ILE . 2.4 ttt180 -76.05 -38.45 57.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.367 -0.379 . . . . 2.17 110.334 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 10.8 mm100 -69.61 -22.79 63.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.063 0.459 . . . . 2.41 110.251 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.28 27.24 40.69 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.005 -0.617 . . . . 2.74 112.506 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.2 m -117.56 153.13 50.36 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.547 0.213 . . . . 2.66 110.814 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.79 173.97 11.1 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.399 2.066 . . . . 2.93 111.836 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.4 tpt -74.57 148.94 40.37 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.649 -0.25 . . . . 2.52 110.753 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 70.06 16.72 7.48 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.636 -0.711 . . . . 3.65 112.167 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.5 p -92.42 -26.62 17.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.242 0.544 . . . . 2.87 109.698 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.7 mt -121.22 146.28 46.96 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.579 -0.737 . . . . 2.52 110.227 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.444 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.5 ptt-85 -119.3 131.26 55.72 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.142 -0.688 . . . . 3.47 109.142 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.1 m-85 -99.87 133.83 43.66 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.964 -0.562 . . . . 2.4 110.675 -178.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.7 mt -115.89 131.74 56.85 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.961 -0.563 . . . . 3.2 110.665 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -134.97 114.49 12.55 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.424 -0.807 . . . . 2.97 109.069 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 62.98 23.2 13.89 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.09 0.472 . . . . 3.64 110.798 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.42 -12.55 68.74 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.953 -0.642 . . . . 3.75 112.452 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -103.51 138.48 40.16 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.663 -0.316 . . . . 4.67 110.279 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.2 ptm180 -76.28 142.37 41.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.136 0.493 . . . . 3.55 110.476 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.3 mm -75.75 117.8 20.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.798 -0.637 . . . . 2.55 111.811 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.32 157.39 18.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.663 -0.698 . . . . 2.89 109.64 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -67.85 -29.08 68.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.317 0.58 . . . . 2.44 110.629 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -82.73 -4.42 57.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.697 -0.683 . . . . 3.29 111.177 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -81.76 145.46 30.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.105 0.479 . . . . 3.27 111.058 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 21.1 p -127.47 161.07 56.98 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 2.53 109.7 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -65.39 -11.5 30.55 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.367 2.045 . . . . 2.21 111.923 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.41 -36.17 71.24 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.829 -0.623 . . . . 2.92 110.313 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 4.2 pt-20 -97.95 -178.68 4.16 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.433 -0.581 . . . . 3.18 109.433 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 23.7 mt 73.92 -49.94 0.68 Allowed 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.666 0.604 . . . . 3.04 110.896 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.06 50.74 0.62 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.998 -0.62 . . . . 2.76 112.137 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 33.3 mtt -77.39 137.23 38.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.36 . . . . 2.41 110.778 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -122.79 174.13 7.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.11 -0.496 . . . . 3.44 110.465 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -63.98 129.03 38.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 2.34 110.898 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 58.26 49.36 11.26 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.295 0.569 . . . . 2.55 110.879 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -79.31 178.58 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.652 -0.703 . . . . 2.28 110.232 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.3 t -117.74 131.79 69.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.834 0.35 . . . . 2.19 111.181 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 17.0 tt -134.81 132.5 53.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.288 -0.634 . . . . 1.86 109.288 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -98.42 151.69 20.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.77 0.319 . . . . 2.9 111.466 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -131.32 127.02 59.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.045 -0.525 . . . . 2.36 110.353 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.05 160.54 35.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.949 -0.569 . . . . 2.94 109.823 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -85.65 145.55 27.26 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.874 0.368 . . . . 3.63 110.945 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.444 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.2 mm-40 -84.62 133.27 34.42 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.179 -0.464 . . . . 3.61 110.91 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -64.6 -28.47 69.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.859 -0.61 . . . . 4.92 110.353 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -15.87 63.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 4.41 111.458 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.07 -55.04 3.28 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.004 -0.617 . . . . 3.73 112.104 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.627 -1.096 . . . . 3.68 111.518 179.903 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.653 0.263 . . . . 7.46 110.409 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.477 HG12 ' N ' ' A' ' 35' ' ' HIS . 0.4 OUTLIER -102.97 106.67 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 N-CA-C 109.397 -0.594 . . . . 2.65 109.397 179.67 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -97.97 128.76 44.73 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.745 -0.662 . . . . 2.5 110.16 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.644 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -85.14 106.74 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.614 0 N-CA-C 109.879 -0.415 . . . . 2.13 109.879 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.589 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 23.4 mt -69.93 122.0 20.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 109.073 -0.714 . . . . 1.61 109.073 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -70.26 106.71 3.43 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.688 -0.687 . . . . 2.53 111.836 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 8.4 mt -118.01 -14.2 9.99 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.502 -0.555 . . . . 1.77 109.502 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' THR . . . . . 0.464 HG21 ' CD1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -83.8 20.07 1.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.929 -0.578 . . . . 3.0 111.238 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 40.5 pt -66.74 -33.82 65.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.181 0.515 . . . . 3.74 109.769 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -103.06 101.56 11.54 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.604 -0.725 . . . . 6.22 109.906 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 3.0 t -132.61 -54.71 0.95 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.783 -0.644 . . . . 5.71 109.608 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 58.6 m -122.92 -13.39 7.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.965 0.412 . . . . 6.23 110.879 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.4 m -126.37 153.92 44.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.315 -0.402 . . . . 5.9 110.334 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.037 -0.529 . . . . 5.62 110.9 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.465 ' CD2' HG21 ' B' ' 8' ' ' THR . 16.8 m-85 . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 109.822 -0.436 . . . . 2.72 109.822 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.428 ' O ' HG22 ' A' ' 38' ' ' VAL . 45.1 mm -75.31 130.38 36.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.913 0.387 . . . . 1.99 110.901 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -110.23 126.81 54.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.872 0.368 . . . . 3.07 110.62 179.124 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 71.9 mt -104.38 132.77 50.26 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.242 -0.651 . . . . 1.36 109.242 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 86' ' ' ASP . 1.7 ptpm? -99.5 113.42 25.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 2.7 110.598 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.648 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.2 t -83.41 121.1 35.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.064 -0.971 . . . . 1.62 110.003 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.533 ' HA ' ' O ' ' A' ' 32' ' ' SER . 43.2 mm -105.78 124.76 61.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.254 -0.43 . . . . 2.39 110.946 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.4 178.82 35.76 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.826 -0.624 . . . . 2.64 112.187 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -70.01 -31.03 68.49 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 3.73 111.03 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -87.61 24.46 1.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.937 0.399 . . . . 3.07 111.085 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.5 m 62.01 37.96 14.51 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.636 -0.711 . . . . 3.25 111.649 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.533 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 1.2 p -91.07 145.96 24.25 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.212 -0.449 . . . . 2.47 110.363 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -127.76 118.8 24.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.978 0.418 . . . . 2.99 110.315 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.2 mt -120.27 130.57 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 1.81 109.482 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.668 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 14.6 m170 -88.21 148.53 24.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.508 . . . . 2.04 110.987 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -133.65 113.09 11.99 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.135 -0.484 . . . . 1.53 110.852 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.445 ' HB2' HG22 ' B' ' 4' ' ' VAL . 6.1 ttmt -81.36 101.42 9.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 2.4 110.431 179.081 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.428 HG22 ' O ' ' A' ' 22' ' ' ILE . 5.3 m -108.06 156.88 8.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.361 . . . . 1.57 110.718 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.771 ' HB2' HG22 ' B' ' 8' ' ' THR . 37.4 tttm -113.83 129.66 56.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.193 -0.458 . . . . 3.2 109.89 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.7 ttp -71.44 85.53 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.287 0.565 . . . . 3.01 110.263 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 21.8 m -165.04 -59.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.33 -0.85 . . . . 2.21 109.082 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 149.45 29.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.346 -0.843 . . . . 1.75 111.134 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.71 -178.92 2.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.154 -0.475 . . . . 2.43 110.37 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.406 HD13 HG23 ' A' ' 71' ' ' ILE . 1.5 mt -78.34 -3.37 42.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.438 -0.346 . . . . 1.89 111.27 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -61.73 -53.24 58.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.991 0.424 . . . . 2.44 110.179 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -65.43 -36.16 83.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.874 -0.603 . . . . 2.08 110.721 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.62 -43.34 99.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.916 -0.583 . . . . 2.54 111.274 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -66.64 -50.34 63.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.209 0.448 . . . . 2.26 112.209 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.4 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 6.7 pt-20 -64.55 -43.53 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.68 0.622 . . . . 1.88 112.68 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 m -64.62 -33.07 75.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.61 0.243 . . . . 1.46 111.361 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -68.6 -42.46 78.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.907 -0.405 . . . . 1.69 109.907 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.34 -35.33 78.76 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 1.99 110.809 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.4 -35.85 82.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 2.17 110.453 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -72.17 -34.54 68.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 2.17 110.76 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -81.31 -13.62 58.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 2.41 110.497 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.09 39.67 44.64 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.163 -0.542 . . . . 2.74 112.63 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.6 m -137.5 156.0 75.14 Favored Pre-proline 0 C--N 1.328 -0.351 0 N-CA-C 110.408 -0.219 . . . . 2.66 110.408 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.31 146.8 90.61 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.666 2.244 . . . . 2.93 112.645 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.4 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 5.2 ttt -78.5 55.29 1.59 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.892 -0.594 . . . . 2.52 111.097 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -156.87 -16.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.112 -0.494 . . . . 3.65 111.167 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.7 p -96.62 -8.61 31.25 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.119 -0.232 . . . . 2.87 111.256 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 23.0 mt -115.35 126.74 54.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.9 0.381 . . . . 2.52 110.633 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.1 ptt-85 -115.06 128.67 56.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 3.47 110.019 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -96.14 132.78 41.19 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.785 -0.643 . . . . 2.4 109.65 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.5 mt -118.29 142.58 47.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.027 0.442 . . . . 3.2 111.319 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -135.43 107.06 6.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.278 -0.874 . . . . 2.97 109.034 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 61.09 34.04 19.26 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.052 0.454 . . . . 3.64 111.175 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.57 -19.76 42.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.018 -0.611 . . . . 3.75 112.759 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -89.9 133.86 34.53 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.15 -0.315 . . . . 4.67 110.15 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.1 ptm85 -77.76 138.4 38.99 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.299 -0.56 . . . . 3.55 110.324 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.406 HG23 HD13 ' A' ' 44' ' ' LEU . 42.3 mm -79.27 111.35 16.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.648 -0.706 . . . . 2.55 111.267 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.29 162.77 22.17 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 2.89 109.832 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.88 -30.85 71.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.862 -0.608 . . . . 2.44 111.476 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -82.84 4.22 26.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 3.29 112.031 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -81.05 164.96 22.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.826 0.346 . . . . 3.27 110.841 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.429 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 8.9 t -155.77 146.21 16.03 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.438 -0.579 . . . . 2.53 109.438 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.56 -17.07 16.0 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.953 2.435 . . . . 2.21 112.927 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -73.32 -15.83 61.38 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.228 -0.442 . . . . 2.92 110.787 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 12.5 pt-20 -119.38 171.4 8.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 3.18 109.496 178.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 92.2 mt 73.13 -3.23 2.5 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.668 0.605 . . . . 3.04 111.153 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.81 47.3 40.58 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 121.033 -0.604 . . . . 2.76 113.053 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 10.1 mtt -73.2 131.57 42.16 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.858 -0.423 . . . . 2.41 109.858 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 46.1 mt-10 -119.93 178.7 4.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.068 0.461 . . . . 3.44 111.606 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -67.92 138.83 56.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.483 -0.78 . . . . 2.34 110.535 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 57.59 39.05 27.98 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.593 0.558 . . . . 2.55 110.641 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 25' ' ' LYS . 1.0 OUTLIER -77.47 164.76 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.015 -0.538 . . . . 2.28 110.39 -179.803 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.0 t -103.19 132.86 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.144 0.497 . . . . 2.19 111.877 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.648 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -132.98 127.82 55.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.691 -0.855 . . . . 1.86 108.691 178.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -103.89 142.14 34.92 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.69 0.281 . . . . 2.9 111.036 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.9 p -121.43 126.96 75.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.162 0.506 . . . . 2.36 110.206 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -130.72 165.46 22.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.896 -0.593 . . . . 2.94 109.693 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -96.24 139.05 32.95 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.943 0.402 . . . . 3.63 110.906 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.92 146.5 39.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.873 -0.603 . . . . 3.61 109.584 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -69.42 -25.7 64.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.433 -0.349 . . . . 4.92 111.303 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.93 -18.51 62.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.232 -0.44 . . . . 4.41 111.437 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.88 -1.27 79.77 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.809 -0.71 . . . . 3.73 112.593 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.944 -0.92 . . . . 3.68 111.337 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 29.4 tttt . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 110.174 -0.306 . . . . 7.46 110.174 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.0 t -80.67 104.02 8.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 N-CA-C 108.935 -0.765 . . . . 2.65 108.935 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -119.92 112.81 19.66 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.949 -1.13 . . . . 2.5 107.949 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.668 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 12.2 p -84.74 110.75 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.826 0 CA-C-O 122.062 0.934 . . . . 2.13 110.624 -177.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.446 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 6.4 mt -77.81 117.2 22.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 114.607 -1.179 . . . . 1.61 109.859 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.29 106.31 8.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.805 0.336 . . . . 2.53 110.909 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.413 HD22 ' CZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -112.92 11.23 19.1 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.521 0.676 . . . . 1.77 109.346 178.172 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 8' ' ' THR . . . . . 0.771 HG22 ' HB2' ' A' ' 39' ' ' LYS . 67.3 p -93.36 8.85 38.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.229 -0.896 . . . . 3.0 110.225 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 7.2 tp -61.54 124.74 16.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.459 -0.792 . . . . 3.74 111.374 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.5 -30.42 7.14 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.329 -0.85 . . . . 6.22 110.019 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 7.2 m -82.97 -178.9 7.28 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.256 -0.883 . . . . 5.71 110.776 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -86.56 -27.05 24.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.551 0.215 . . . . 6.23 111.435 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.63 107.04 5.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.673 0.273 . . . . 5.9 110.855 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.039 -0.528 . . . . 5.62 110.877 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.45 ' CD2' HG22 ' B' ' 8' ' ' THR . 12.6 m-85 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 110.005 -0.368 . . . . 2.72 110.005 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mm -79.4 142.46 13.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.353 -0.385 . . . . 1.99 111.204 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HB2' ' NZ ' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -121.28 119.27 31.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.343 -0.389 . . . . 3.07 110.046 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 87.1 mt -103.51 144.59 31.21 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.221 -0.445 . . . . 1.36 110.0 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 mttp -99.81 103.08 14.68 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.313 -0.403 . . . . 2.7 110.625 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 11.0 t -88.03 124.94 41.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.922 -0.581 . . . . 1.62 109.534 179.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 32' ' ' SER . 10.8 mm -119.37 137.41 53.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.014 0.435 . . . . 2.39 111.533 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -112.18 172.76 14.96 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.923 -0.58 . . . . 2.64 111.969 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 31.6 tp60 -65.52 -20.36 66.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.166 0.507 . . . . 3.73 111.325 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -89.31 18.42 5.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.389 -0.369 . . . . 3.07 110.678 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.4 m 59.36 39.93 21.64 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.67 -0.696 . . . . 3.25 111.239 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 2.0 p -91.01 142.86 27.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.766 -0.652 . . . . 2.47 110.174 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -121.97 114.69 21.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.06 0.457 . . . . 2.99 110.063 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.4 mm -126.03 133.55 68.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.979 -0.555 . . . . 1.81 110.473 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.644 ' HB3' HG13 ' B' ' 4' ' ' VAL . 0.2 OUTLIER -91.99 150.2 21.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.061 0.458 . . . . 2.04 110.219 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.549 ' HE1' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -131.11 108.58 9.85 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.315 -0.402 . . . . 1.53 111.832 -178.873 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.576 ' HG3' HG11 ' B' ' 4' ' ' VAL . 11.8 mtmt -81.58 101.51 10.04 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.749 -0.463 . . . . 2.4 109.749 178.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.464 HG11 HD23 ' A' ' 47' ' ' LEU . 17.1 m -115.85 166.94 9.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.175 0.512 . . . . 1.57 112.287 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HD3' ' HB2' ' B' ' 10' ' ' GLU . 53.4 tttp -115.04 136.51 53.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.322 -0.854 . . . . 3.2 108.987 179.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 43.4 ttp -78.3 85.31 4.44 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.754 0.311 . . . . 3.01 110.495 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.45 -44.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.605 -0.725 . . . . 2.21 109.853 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 148.17 36.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.683 -0.69 . . . . 1.75 111.266 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -67.17 167.85 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 2.43 110.362 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.409 HD13 HD12 ' A' ' 71' ' ' ILE . 78.7 mt -75.29 -3.81 35.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 1.89 111.08 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.88 -47.2 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.261 -0.644 . . . . 2.44 109.261 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -57.09 -40.1 76.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.272 -0.876 . . . . 2.08 110.73 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.464 HD23 HG11 ' A' ' 38' ' ' VAL . 1.4 tm? -57.03 -39.2 74.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.587 -0.733 . . . . 2.54 110.895 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -79.0 -55.33 5.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.8 -0.636 . . . . 2.26 112.518 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -44.48 94.91 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.017 0.747 . . . . 1.88 113.017 -177.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.606 ' HB3' HD11 ' B' ' 7' ' ' LEU . 63.3 m -62.91 -35.33 79.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.624 0.193 . . . . 1.46 111.229 -179.181 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -66.9 -45.35 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.577 -0.527 . . . . 1.69 109.577 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 59.5 m -62.17 -37.36 84.96 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.823 -0.626 . . . . 1.99 110.342 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -61.32 -44.45 97.18 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.975 -0.557 . . . . 2.17 111.13 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.417 ' CZ ' HG12 ' B' ' 5' ' ' ILE . 10.4 ttp180 -76.41 -24.49 54.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.846 0.355 . . . . 2.17 110.837 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -75.48 -33.79 60.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.361 -0.382 . . . . 2.41 110.266 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.44 32.34 6.7 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.766 -0.652 . . . . 2.74 111.851 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.21 152.26 79.83 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 122.928 -0.16 . . . . 2.66 110.595 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.47 154.39 74.51 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.646 2.231 . . . . 2.93 112.129 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.497 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 11.3 tpt -66.59 145.53 55.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.256 -0.429 . . . . 2.52 110.572 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.3 m120 76.54 10.18 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.523 0.729 . . . . 3.65 112.344 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.7 p -90.38 -17.71 26.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.297 -0.631 . . . . 2.87 109.297 178.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 92' ' ' GLN . 72.6 mt -124.15 149.13 46.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.362 -0.835 . . . . 2.52 110.092 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.529 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 32.5 ptt-85 -119.2 128.61 54.38 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.042 0.449 . . . . 3.47 109.886 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.411 ' HB3' HD11 ' A' ' 88' ' ' ILE . 68.3 m-85 -95.81 132.71 40.77 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.946 -0.57 . . . . 2.4 109.841 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.8 mt -112.47 138.59 49.01 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.212 0.529 . . . . 3.2 111.307 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -138.41 110.12 7.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 2.97 108.51 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 64.52 31.92 12.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.939 -0.573 . . . . 3.64 110.873 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.53 -31.53 6.72 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.858 -0.686 . . . . 3.75 113.173 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -87.62 161.41 17.71 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.435 -0.209 . . . . 4.67 110.435 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.2 ptm180 -94.04 143.66 26.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.968 0.413 . . . . 3.55 110.584 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.409 HD12 HD13 ' A' ' 44' ' ' LEU . 30.4 mm -78.46 121.57 31.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.858 -0.61 . . . . 2.55 111.81 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -88.74 157.19 18.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 2.89 109.891 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -68.9 -22.28 64.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.385 -0.37 . . . . 2.44 111.884 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -95.17 8.68 42.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.682 0.277 . . . . 3.29 111.625 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -90.79 153.42 20.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.777 0.322 . . . . 3.27 110.403 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.6 p -123.18 161.38 45.31 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.236 -0.438 . . . . 2.53 111.307 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -68.54 -17.89 43.32 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.685 2.257 . . . . 2.21 111.845 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.1 -42.49 66.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.895 -0.593 . . . . 2.92 110.546 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.425 ' HG3' ' HG ' ' A' ' 80' ' ' LEU . 15.1 pt-20 -84.09 176.01 9.1 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.102 -0.499 . . . . 3.18 110.243 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.425 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 33.1 mt 73.38 -42.56 0.53 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.502 0.721 . . . . 3.04 111.88 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.41 54.29 0.66 Allowed Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.648 -0.581 . . . . 2.76 111.648 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.7 ttm -90.47 115.58 27.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.955 0.407 . . . . 2.41 110.15 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 34.5 mt-10 -103.53 -178.74 3.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.065 -0.516 . . . . 3.44 111.375 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.523 ' HG3' ' HG2' ' A' ' 85' ' ' GLU . 10.1 tp10 -73.4 142.81 46.96 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.109 -0.7 . . . . 2.34 109.109 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.523 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 81.2 mm-40 60.32 41.27 16.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.194 0.521 . . . . 2.55 109.923 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.4 t0 -85.55 172.46 10.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 2.28 110.973 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.4 t -117.92 138.72 47.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.04 0.447 . . . . 2.19 111.668 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.524 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 10.4 tt -142.54 127.92 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.536 -0.756 . . . . 1.86 109.035 178.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -97.95 160.0 14.58 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.896 0.379 . . . . 2.9 111.452 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 p -138.1 127.57 33.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.935 -0.575 . . . . 2.36 109.916 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -132.85 153.21 51.54 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.455 -0.339 . . . . 2.94 110.392 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.545 ' HA ' HD23 ' A' ' 62' ' ' LEU . 41.2 tt0 -78.48 134.57 37.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.281 -0.418 . . . . 3.63 110.91 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.529 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.9 mm-40 -78.01 143.19 37.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.182 -0.463 . . . . 3.61 110.026 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -62.35 -23.75 66.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.95 -0.568 . . . . 4.92 111.001 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.4 p -71.84 -30.37 65.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.782 -0.645 . . . . 4.41 110.763 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.91 15.07 81.66 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.761 -0.654 . . . . 3.73 112.233 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.88 0 CA-C-O 119.161 -0.799 . . . . 3.68 111.346 -179.858 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 17.1 mtpp . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.746 0.307 . . . . 7.46 110.214 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 m -96.68 110.86 25.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 116.191 -0.459 . . . . 2.65 110.535 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -73.72 122.13 21.88 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.451 -0.944 . . . . 2.5 108.451 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.644 HG13 ' HB3' ' A' ' 35' ' ' HIS . 1.9 t -93.42 107.0 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-O 120.9 0.381 . . . . 2.13 111.163 -178.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.528 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 16.2 mt -70.91 128.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.077 -0.712 . . . . 1.61 109.077 178.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -80.6 105.85 12.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.832 0.348 . . . . 2.53 111.147 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.606 HD11 ' HB3' ' A' ' 50' ' ' SER . 1.3 tp -119.07 18.83 13.08 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.452 -0.944 . . . . 1.77 108.452 177.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' THR . . . . . 0.45 HG22 ' CD2' ' A' ' 21' ' ' TYR . 58.2 p -74.39 0.45 14.44 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.517 -1.22 . . . . 3.0 111.197 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 8.0 mm -80.41 74.88 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.434 0.635 . . . . 3.74 110.911 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.639 ' HG3' ' H ' ' B' ' 13' ' ' SER . 12.0 tp10 -74.51 134.09 42.27 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.4 -0.818 . . . . 6.22 109.875 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 18.4 m -72.26 -32.7 66.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.492 -0.322 . . . . 5.71 111.124 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 2.2 m -69.78 -36.7 75.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.138 0.494 . . . . 6.23 110.64 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' SER . . . . . 0.639 ' H ' ' HG3' ' B' ' 10' ' ' GLU . 5.1 m -141.31 101.67 4.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.82 -0.627 . . . . 5.9 109.601 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 27.9 t70 . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.191 -0.458 . . . . 5.62 110.943 -179.419 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm . . . . . 0 N--CA 1.456 -0.149 0 N-CA-C 110.205 -0.294 . . . . 1.99 110.205 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.0 ttpm? -113.72 120.22 40.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.29 0.567 . . . . 3.0699999999999998 111.538 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.5 mt -104.18 150.24 24.55 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.139 -0.689 . . . . 1.3600000000000001 109.139 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -103.93 121.39 43.03 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.92 -0.312 . . . . 2.7000000000000002 110.878 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.6 t -93.08 121.39 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.904 -0.589 . . . . 1.6200000000000001 109.988 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.4 mm -103.37 120.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.907 0.384 . . . . 2.3900000000000001 111.017 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.58 167.87 24.83 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.653 -0.703 . . . . 2.6400000000000001 111.583 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -77.01 -17.71 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.116 0.484 . . . . 3.73 110.639 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -85.88 20.96 2.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.465 . . . . 3.0699999999999998 110.364 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 58.96 64.3 1.44 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.596 -0.729 . . . . 3.25 110.91 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -135.76 144.58 45.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.491 -0.777 . . . . 2.4700000000000002 110.462 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -126.04 94.3 4.06 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.443 -0.577 . . . . 2.9900000000000002 109.443 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 9.8 mm -90.5 145.4 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.056 -0.52 . . . . 1.8100000000000001 110.9 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 32.6 m170 -89.02 132.98 34.5 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.888 -0.782 . . . . 2.04 108.888 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.453 ' CE1' HD12 ' B' ' 7' ' ' LEU . 0.8 OUTLIER -123.16 110.52 15.37 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.817 0.341 . . . . 1.53 110.884 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.574 ' HB2' HG22 ' B' ' 4' ' ' VAL . 24.3 ttmt -81.48 110.65 17.08 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.949 -0.569 . . . . 2.3999999999999999 110.712 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.7 m -114.13 154.69 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.088 0.47 . . . . 1.5700000000000001 110.465 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.519 ' HG2' HG22 ' A' ' 41' ' ' THR . 52.6 tttt -106.67 127.27 53.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.378 -0.374 . . . . 3.2000000000000002 110.143 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.647 ' O ' ' HB ' ' A' ' 41' ' ' THR . 63.1 tpp -74.3 85.88 1.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 3.0099999999999998 110.565 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.647 ' HB ' ' O ' ' A' ' 40' ' ' MET . 7.4 t 154.31 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.274 1.03 . . . . 2.21 109.055 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.6 m -84.33 134.89 34.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.867 -0.606 . . . . 1.75 110.573 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.15 132.95 54.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.929 -0.578 . . . . 2.4300000000000002 110.104 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.93 -18.45 60.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 1.8899999999999999 110.833 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 34.0 tptt -53.9 -47.41 71.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.265 0.555 . . . . 2.4399999999999999 109.764 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.9 -43.35 83.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.257 -0.883 . . . . 2.0800000000000001 111.063 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -44.76 96.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.836 0.351 . . . . 2.54 111.077 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -61.25 -52.82 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.041 -0.527 . . . . 2.2599999999999998 112.354 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.7 pt-20 -63.32 -44.12 95.86 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.422 0.527 . . . . 1.8799999999999999 112.422 -178.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.68 ' HB2' HD13 ' B' ' 7' ' ' LEU . 3.9 m -65.55 -33.44 75.93 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.275 -0.17 . . . . 1.46 111.347 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -69.31 -37.28 77.7 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.574 -0.45 . . . . 1.6899999999999999 110.012 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 66.7 m -60.95 -39.7 90.48 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.256 -0.646 . . . . 1.99 109.256 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 85.1 mt-30 -63.79 -39.65 94.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.283 -0.872 . . . . 2.1699999999999999 110.156 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -64.84 -33.62 76.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.055 0.455 . . . . 2.1699999999999999 109.788 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -70.87 -35.59 72.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.862 -0.608 . . . . 2.4100000000000001 110.03 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.65 20.63 8.81 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.01 -0.614 . . . . 2.7400000000000002 112.088 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.7 m -132.62 155.83 80.78 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.438 -0.208 . . . . 2.6600000000000001 110.438 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.51 164.03 36.75 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.239 1.959 . . . . 2.9300000000000002 111.217 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 12.3 ttt -71.27 163.04 28.42 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 121.172 -0.211 . . . . 2.52 110.564 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' MET . 16.2 m120 75.7 -0.85 3.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.301 0.64 . . . . 3.6499999999999999 111.843 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.6 p -85.26 -29.96 24.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.19 0.519 . . . . 2.8700000000000001 109.809 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.6 mt -119.59 146.13 45.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.472 -0.786 . . . . 2.52 110.594 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -110.8 134.04 52.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.982 -0.554 . . . . 3.4700000000000002 110.023 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -96.44 120.53 36.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 2.3999999999999999 109.315 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.5 mt -108.19 130.57 55.13 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.284 0.564 . . . . 3.2000000000000002 111.572 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -127.46 108.2 10.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.076 -0.965 . . . . 2.9700000000000002 108.409 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.94 17.46 10.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 3.6400000000000001 111.013 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.77 -26.65 20.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.085 -0.579 . . . . 3.75 112.285 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -87.03 145.9 26.31 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.87 -0.419 . . . . 4.6699999999999999 109.87 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -81.42 133.71 35.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.219 0.533 . . . . 3.5499999999999998 110.383 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.403 HD13 ' HA ' ' A' ' 71' ' ' ILE . 24.0 mm -74.2 113.89 13.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.818 -0.628 . . . . 2.5499999999999998 110.318 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HB3' ' CD2' ' A' ' 75' ' ' HIS . . . -72.38 155.72 39.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.809 -0.632 . . . . 2.8900000000000001 110.497 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -65.23 -34.73 79.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.364 0.602 . . . . 2.4399999999999999 110.434 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -86.99 34.24 0.67 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.523 -0.762 . . . . 3.29 111.977 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.427 ' CD2' ' HB3' ' A' ' 72' ' ' ALA . 17.2 m170 -114.91 159.34 20.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.11 0.481 . . . . 3.27 111.086 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.493 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 3.0 p -133.83 157.69 77.21 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.657 -0.702 . . . . 2.5299999999999998 109.761 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -64.28 -14.29 43.04 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.412 2.075 . . . . 2.21 112.762 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -68.37 -36.35 79.06 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.217 -0.447 . . . . 2.9199999999999999 110.673 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.07 177.65 5.91 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.422 -0.584 . . . . 3.1800000000000002 109.422 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.6 mt 73.62 -47.29 0.65 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 123.652 0.595 . . . . 3.04 110.825 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.71 47.06 0.75 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.091 -0.576 . . . . 2.7599999999999998 111.858 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.6 mtt -77.85 132.98 38.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.945 0.402 . . . . 2.4100000000000001 110.62 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 32.3 mt-10 -126.2 177.04 6.64 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.121 -0.491 . . . . 3.4399999999999999 110.788 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.416 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.7 tp10 -71.87 143.13 49.51 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.088 -0.708 . . . . 2.3399999999999999 109.088 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 66.64 28.42 9.19 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.504 0.503 . . . . 2.5499999999999998 110.577 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.2 t0 -74.59 168.92 18.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.032 -0.531 . . . . 2.2799999999999998 110.403 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.5 t -120.19 124.62 73.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.754 0.311 . . . . 2.1899999999999999 111.245 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -125.31 133.05 70.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.572 -0.529 . . . . 1.8600000000000001 109.572 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.11 150.57 23.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.914 0.388 . . . . 2.8999999999999999 111.217 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -133.96 128.12 52.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.002 -0.545 . . . . 2.3599999999999999 110.521 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -132.96 162.25 32.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.262 -0.426 . . . . 2.9399999999999999 110.09 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -89.97 134.88 33.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.021 0.439 . . . . 3.6299999999999999 110.981 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -72.39 150.26 43.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 3.6099999999999999 109.624 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -63.14 -35.97 82.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.388 -0.369 . . . . 4.9199999999999999 111.509 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 p -68.13 -31.63 71.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.859 0.361 . . . . 4.4100000000000001 111.212 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.57 -10.05 68.92 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.017 -0.611 . . . . 3.73 111.941 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.707 -1.052 . . . . 3.6800000000000002 111.974 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.574 HG22 ' HB2' ' A' ' 37' ' ' LYS . 12.1 p . . . . . 0 N--CA 1.436 -1.136 0 N-CA-C 108.603 -0.888 . . . . 2.1299999999999999 108.603 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.472 HG22 ' HG ' ' B' ' 7' ' ' LEU . 3.9 mt -68.86 104.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.701 -0.682 . . . . 1.6100000000000001 110.33 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -83.16 104.6 13.47 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.836 -0.62 . . . . 2.5299999999999998 110.486 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' A' ' 50' ' ' SER . 96.7 mt . . . . . 0 C--N 1.317 -0.83 0 CA-C-O 121.238 0.542 . . . . 1.77 109.678 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.9 mm . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.787 0.327 . . . . 1.99 110.736 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.645 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -97.69 123.37 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 3.0699999999999998 110.678 179.201 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 36' ' ' PHE . 70.8 mt -110.58 118.2 35.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.871 -0.604 . . . . 1.3600000000000001 109.517 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -80.83 109.32 15.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.905 0.383 . . . . 2.7000000000000002 110.631 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.1 t -81.02 115.46 23.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.734 -0.666 . . . . 1.6200000000000001 109.999 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.5 mm -107.3 126.97 63.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.031 -0.531 . . . . 2.3900000000000001 110.707 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.57 172.32 21.9 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.797 -0.716 . . . . 2.6400000000000001 111.855 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -64.72 -23.07 67.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.163 0.506 . . . . 3.73 111.113 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.71 15.87 5.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.214 -0.448 . . . . 3.0699999999999998 110.634 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.5 m 61.92 37.01 15.48 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.958 -0.565 . . . . 3.25 111.036 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -86.39 152.14 22.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.856 -0.611 . . . . 2.4700000000000002 110.798 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -125.99 115.64 20.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.266 -0.424 . . . . 2.9900000000000002 110.323 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.422 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 70.4 mt -125.97 139.38 51.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.51 -0.552 . . . . 1.8100000000000001 109.51 179.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.843 ' HB3' HG13 ' B' ' 4' ' ' VAL . 10.5 m170 -88.54 158.44 18.3 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.184 0.516 . . . . 2.04 111.176 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.645 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.05 120.12 12.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.279 -0.419 . . . . 1.53 110.765 -179.365 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.505 ' N ' HG12 ' B' ' 4' ' ' VAL . 5.2 mtmt -100.02 96.87 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.664 0.268 . . . . 2.3999999999999999 110.376 179.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 m -113.8 162.66 11.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.896 0.379 . . . . 1.5700000000000001 110.945 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.5 tttt -128.28 141.43 51.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.189 -0.46 . . . . 3.2000000000000002 109.899 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.6 ttm -78.09 84.99 4.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.303 0.573 . . . . 3.0099999999999998 110.331 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 16.2 m -163.74 -46.32 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.327 -0.852 . . . . 2.21 109.115 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.69 149.07 22.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.296 -0.865 . . . . 1.75 111.507 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -63.93 152.59 39.5 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.27 -0.423 . . . . 2.4300000000000002 110.42 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.7 mt -67.82 -11.86 59.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.766 0.317 . . . . 1.8899999999999999 111.177 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -65.85 -30.71 71.37 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.343 -0.614 . . . . 2.4399999999999999 109.343 178.64 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.436 ' N ' ' HG3' ' A' ' 45' ' ' LYS . 42.4 tptt -68.88 -32.73 72.6 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.5 -0.773 . . . . 2.0800000000000001 109.074 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' B' ' 7' ' ' LEU . 0.5 OUTLIER -68.81 -41.69 78.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.195 -0.911 . . . . 2.54 110.043 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -64.5 -51.78 61.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.464 -0.789 . . . . 2.2599999999999998 111.834 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.6 pt-20 -66.29 -43.64 85.75 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.302 0.482 . . . . 1.8799999999999999 112.302 -178.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.44 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 50.3 m -61.46 -36.58 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 122.4 -0.187 . . . . 1.46 111.384 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -68.88 -38.54 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.822 -0.436 . . . . 1.6899999999999999 109.822 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 75.4 m -63.13 -42.27 99.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 1.99 109.698 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.44 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.7 mt-30 -64.99 -35.62 81.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.853 -0.612 . . . . 2.1699999999999999 110.2 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.08 -42.45 80.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.744 -0.662 . . . . 2.1699999999999999 110.778 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -79.23 -11.81 59.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 2.4100000000000001 111.332 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.5 31.67 44.93 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.014 -0.612 . . . . 2.7400000000000002 112.632 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.9 m -121.78 156.53 58.93 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 122.892 -0.181 . . . . 2.6600000000000001 110.731 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -69.54 159.99 51.45 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.642 2.228 . . . . 2.9300000000000002 112.103 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.8 145.58 53.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.234 -0.439 . . . . 2.52 111.16 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 71.64 16.81 5.7 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.702 0.801 . . . . 3.6499999999999999 112.541 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.2 p -92.42 -27.6 17.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.461 0.648 . . . . 2.8700000000000001 109.611 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.3 mt -111.66 141.75 44.86 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.21 -0.904 . . . . 2.52 110.245 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.467 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 11.4 ptt180 -107.92 118.95 38.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.546 -0.539 . . . . 3.4700000000000002 109.546 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.04 124.81 35.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.619 -0.719 . . . . 2.3999999999999999 109.748 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.7 mt -114.34 136.7 52.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.335 0.588 . . . . 3.2000000000000002 112.052 -178.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.408 ' HB2' HD11 ' A' ' 71' ' ' ILE . 78.7 t80 -129.94 107.47 9.39 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.741 -1.118 . . . . 2.9700000000000002 108.521 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 61.27 35.23 18.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.979 -0.555 . . . . 3.6400000000000001 110.982 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.3 -5.42 84.42 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.865 -0.607 . . . . 3.75 113.202 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -104.48 148.0 26.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.152 -0.314 . . . . 4.6699999999999999 110.152 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 70' ' ' ARG . 12.4 ptm180 -85.94 139.47 31.18 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.43 -0.508 . . . . 3.5499999999999998 110.476 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 66' ' ' PHE . 37.4 mm -75.27 113.82 14.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.839 -0.619 . . . . 2.5499999999999998 111.403 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.13 161.42 22.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.161 -0.472 . . . . 2.8900000000000001 110.047 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.5 -23.82 58.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.252 -0.431 . . . . 2.4399999999999999 110.971 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -90.56 3.17 54.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.307 -0.406 . . . . 3.29 110.82 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -85.14 147.08 26.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 3.27 110.512 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 40.1 p -126.11 160.93 54.69 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.077 -0.511 . . . . 2.5299999999999998 110.14 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.37 -7.92 21.54 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.503 2.135 . . . . 2.21 112.023 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -76.23 -31.34 58.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.829 -0.623 . . . . 2.9199999999999999 110.365 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.4 pt-20 -102.33 -171.01 1.89 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 3.1800000000000002 110.355 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 62.2 mt 72.72 -36.24 0.35 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.523 0.729 . . . . 3.04 111.924 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 104.65 35.02 3.38 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.944 -0.646 . . . . 2.7599999999999998 111.856 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.1 mtt -70.12 129.1 38.5 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.913 0.387 . . . . 2.4100000000000001 111.091 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -126.76 176.27 7.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.054 -0.521 . . . . 3.4399999999999999 110.17 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -64.23 142.71 58.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.182 -0.463 . . . . 2.3399999999999999 110.398 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 54.66 50.68 15.36 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.672 0.608 . . . . 2.5499999999999998 111.221 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.68 -175.61 4.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.418 -0.356 . . . . 2.2799999999999998 110.366 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.95 138.67 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 2.1899999999999999 111.407 -178.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.471 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 14.9 tt -137.11 132.27 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.146 -0.687 . . . . 1.8600000000000001 109.146 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -104.36 146.21 29.15 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.596 0.236 . . . . 2.8999999999999999 110.663 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p -131.47 129.95 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.046 0.45 . . . . 2.3599999999999999 110.431 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -134.68 162.79 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.035 -0.53 . . . . 2.9399999999999999 110.135 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -83.9 135.6 34.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.602 -0.272 . . . . 3.6299999999999999 110.852 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.467 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 7.1 mm-40 -77.19 146.91 36.75 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.113 -0.328 . . . . 3.6099999999999999 110.113 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -68.13 -26.0 65.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.868 0.366 . . . . 4.9199999999999999 110.792 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -35.19 79.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.15 -0.477 . . . . 4.4100000000000001 111.125 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.11 -37.65 3.37 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.886 -0.673 . . . . 3.73 112.203 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.909 0 CA-C-O 118.7 -1.056 . . . . 3.6800000000000002 111.762 179.904 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.843 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 120.664 0.268 . . . . 2.1299999999999999 110.853 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.419 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 13.7 mt -69.72 115.98 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.479 -0.563 . . . . 1.6100000000000001 109.479 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . 0.462 ' O ' HD23 ' B' ' 7' ' ' LEU . 20.4 m-20 -72.27 106.13 4.32 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 116.665 -0.243 . . . . 2.5299999999999998 110.948 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.493 ' CD1' ' HA ' ' A' ' 47' ' ' LEU . 11.2 mt . . . . . 0 C--N 1.318 -0.794 0 N-CA-C 109.682 -0.488 . . . . 1.77 109.682 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 84' ' ' GLU . 32.3 mm . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 109.869 -0.419 . . . . 1.99 109.869 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.565 ' HE3' ' CD2' ' A' ' 35' ' ' HIS . 9.6 ttpt -98.62 119.34 37.18 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.352 -0.385 . . . . 3.0699999999999998 110.462 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 85.5 mt -101.58 142.18 33.34 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.929 -0.578 . . . . 1.3600000000000001 110.012 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -97.69 103.08 14.99 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.798 -0.445 . . . . 2.7000000000000002 109.798 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.9 t -82.37 116.08 25.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.108 -0.497 . . . . 1.6200000000000001 110.045 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.526 ' HA ' ' O ' ' A' ' 32' ' ' SER . 38.1 mm -108.16 123.25 63.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.928 -0.578 . . . . 2.3900000000000001 111.159 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.72 177.93 32.09 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.73 -0.748 . . . . 2.6400000000000001 111.591 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -69.0 -20.47 64.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.237 0.542 . . . . 3.73 110.471 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -86.18 11.7 11.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.58 -0.736 . . . . 3.0699999999999998 110.343 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.1 m 62.0 34.11 16.87 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.394 -0.821 . . . . 3.25 111.968 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 29.1 p -92.57 150.19 20.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.318 -0.623 . . . . 2.4700000000000002 109.318 178.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -124.36 112.77 17.35 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.977 -0.379 . . . . 2.9900000000000002 109.977 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 15.8 mm -111.96 142.78 23.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.791 -0.448 . . . . 1.8100000000000001 109.791 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.565 ' CD2' ' HE3' ' A' ' 23' ' ' LYS . 47.5 m170 -91.35 140.26 29.94 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.923 0.392 . . . . 2.04 110.17 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.589 ' HE1' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -131.67 121.69 24.7 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.332 0.493 . . . . 1.53 112.332 -178.385 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.49 ' HE3' ' HB ' ' B' ' 4' ' ' VAL . 32.0 mttt -81.39 99.46 8.71 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.557 -0.292 . . . . 2.3999999999999999 110.474 177.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.7 p -115.53 163.7 12.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.983 0.42 . . . . 1.5700000000000001 111.06 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.32 144.06 46.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.419 -0.355 . . . . 3.2000000000000002 110.154 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.6 84.67 7.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.223 0.535 . . . . 3.0099999999999998 109.744 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -166.8 -60.31 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.653 -0.869 . . . . 2.21 108.653 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.7 m -76.45 148.46 37.24 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.919 -1.037 . . . . 1.75 110.304 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.437 ' HA ' HG22 ' A' ' 76' ' ' THR . 12.8 m-70 -62.12 156.73 20.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.001 0.429 . . . . 2.4300000000000002 111.145 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.09 -5.41 35.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.038 -0.528 . . . . 1.8899999999999999 110.588 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -61.9 -42.91 99.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.496 -0.774 . . . . 2.4399999999999999 109.182 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -61.94 -39.3 91.63 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.584 -0.735 . . . . 2.0800000000000001 109.628 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.441 HD22 ' HA ' ' A' ' 47' ' ' LEU . 0.9 OUTLIER -59.65 -38.39 81.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.293 -0.867 . . . . 2.54 110.184 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -73.05 -52.63 13.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.71 . . . . 2.2599999999999998 112.512 -178.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.488 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 10.0 pt-20 -67.66 -44.31 78.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.936 0.717 . . . . 1.8799999999999999 112.936 -177.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.436 ' HB3' HD11 ' B' ' 7' ' ' LEU . 15.0 m -59.16 -34.94 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.794 0.331 . . . . 1.46 111.172 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.402 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 27.9 t80 -66.38 -44.1 84.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.048 0.451 . . . . 1.6899999999999999 109.818 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 58.0 m -61.66 -33.92 74.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.425 -0.807 . . . . 1.99 110.79 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 97.5 mt-30 -63.31 -40.37 97.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 2.1699999999999999 110.975 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 -74.07 -33.53 63.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 2.1699999999999999 110.619 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 12.4 mm100 -79.79 -8.34 59.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.993 0.425 . . . . 2.4100000000000001 110.77 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.79 36.06 66.23 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.998 -0.546 . . . . 2.7400000000000002 113.14 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.408 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 8.0 m -131.88 149.85 74.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 O-C-N 122.621 -0.34 . . . . 2.6600000000000001 110.698 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -65.84 156.57 63.51 Favored 'Trans proline' 0 N--CA 1.464 -0.206 0 C-N-CA 122.493 2.129 . . . . 2.9300000000000002 111.626 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.509 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 20.3 ttt -69.82 152.98 43.94 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 121.109 -0.236 . . . . 2.52 110.426 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.9 m120 78.96 -0.19 2.39 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.618 0.767 . . . . 3.6499999999999999 112.076 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.3 p -83.68 -24.67 31.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.65 0.738 . . . . 2.8700000000000001 109.131 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -120.61 145.39 47.43 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.911 -1.04 . . . . 2.52 109.836 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HD2' HD11 ' A' ' 65' ' ' LEU . 22.7 ptt-85 -112.33 138.82 48.5 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.043 -0.526 . . . . 3.4700000000000002 109.787 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.431 ' HB3' HD11 ' A' ' 88' ' ' ILE . 49.2 m-85 -107.0 128.26 54.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.482 -0.562 . . . . 2.3999999999999999 109.482 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.411 HD11 ' HD2' ' A' ' 63' ' ' ARG . 6.7 mp -116.14 134.42 54.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.226 0.536 . . . . 3.2000000000000002 112.05 -178.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.403 ' HE1' ' OD1' ' A' ' 86' ' ' ASP . 65.2 t80 -129.63 115.56 17.56 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.354 -0.839 . . . . 2.9700000000000002 109.016 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.39 26.32 15.71 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.818 -0.628 . . . . 3.6400000000000001 111.391 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.64 -20.73 49.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.985 -0.626 . . . . 3.75 113.426 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -99.79 138.68 36.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.955 0.377 . . . . 4.6699999999999999 110.631 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -75.46 135.85 40.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.331 0.586 . . . . 3.5499999999999998 110.469 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 36.9 mm -71.05 126.44 31.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.327 -0.851 . . . . 2.5499999999999998 111.86 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.435 ' HB3' ' CD2' ' A' ' 75' ' ' HIS . . . -91.98 162.59 14.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.668 -0.696 . . . . 2.8900000000000001 109.729 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -72.92 -24.96 60.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.85 0.357 . . . . 2.4399999999999999 111.406 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -87.95 3.61 48.0 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.86 0.362 . . . . 3.29 110.755 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.435 ' CD2' ' HB3' ' A' ' 72' ' ' ALA . 13.9 m170 -86.48 152.21 22.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.008 0.432 . . . . 3.27 111.013 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 20.6 p -129.97 161.77 57.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.612 -0.722 . . . . 2.5299999999999998 109.8 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -69.13 -13.22 35.86 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.389 2.059 . . . . 2.21 111.765 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -74.0 -34.6 64.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.764 -0.653 . . . . 2.9199999999999999 110.418 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.3 pt-20 -91.84 175.88 6.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.43 -0.581 . . . . 3.1800000000000002 109.43 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.422 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 24.1 mt 72.04 -29.96 0.2 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.091 0.556 . . . . 3.04 111.845 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 95.64 36.82 5.21 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.977 -0.63 . . . . 2.7599999999999998 112.181 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 50.2 mtp -73.68 131.24 41.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.765 -0.457 . . . . 2.4100000000000001 109.765 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -125.37 -169.06 1.93 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.741 0.305 . . . . 3.4399999999999999 111.32 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 22' ' ' ILE . 9.9 tp10 -71.06 142.83 50.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.986 -0.552 . . . . 2.3399999999999999 110.606 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 59.8 32.25 21.23 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 123.548 0.53 . . . . 2.5499999999999998 111.223 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.403 ' OD1' ' HE1' ' A' ' 66' ' ' PHE . 1.1 t0 -76.53 171.01 15.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 2.2799999999999998 110.628 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.6 t -118.08 140.34 41.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.084 0.469 . . . . 2.1899999999999999 111.707 -178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.1 tt -139.0 127.64 28.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.149 -0.686 . . . . 1.8600000000000001 109.149 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.418 ' O ' ' HA ' ' A' ' 64' ' ' PHE . 44.5 mt-10 -94.8 149.29 21.4 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.651 0.263 . . . . 2.8999999999999999 111.564 -178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -130.5 125.66 59.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.131 -0.486 . . . . 2.3599999999999999 110.241 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -132.56 161.54 33.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.308 -0.405 . . . . 2.9399999999999999 110.515 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -86.92 130.93 34.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.806 0.336 . . . . 3.6299999999999999 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.73 140.16 42.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.488 -0.324 . . . . 3.6099999999999999 110.17 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -56.56 -36.28 69.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.945 -0.57 . . . . 4.9199999999999999 111.156 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.34 -29.54 70.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.114 -0.494 . . . . 4.4100000000000001 111.847 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.09 -1.04 86.43 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.06 -0.591 . . . . 3.73 112.586 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.692 -1.06 . . . . 3.6800000000000002 111.833 179.89 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 35' ' ' HIS . 1.6 t . . . . . 0 N--CA 1.44 -0.926 0 N-CA-C 109.759 -0.459 . . . . 2.1299999999999999 109.759 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.536 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 21.4 mt -68.64 118.47 12.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.725 -0.472 . . . . 1.6100000000000001 109.725 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -76.51 121.34 22.99 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.871 -0.604 . . . . 2.5299999999999998 111.31 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.589 HD13 ' HE1' ' A' ' 36' ' ' PHE . 2.2 mp . . . . . 0 C--N 1.32 -0.699 0 CA-C-O 121.506 0.67 . . . . 1.77 109.4 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.9 mm . . . . . 0 CA--C 1.523 -0.079 0 CA-C-O 121.059 0.457 . . . . 1.99 111.574 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HZ3' ' HB3' ' A' ' 23' ' ' LYS . 4.3 ttpm? -110.45 118.79 37.2 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.083 -0.508 . . . . 3.0699999999999998 109.726 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -101.52 150.41 23.09 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.92 -0.582 . . . . 1.3600000000000001 110.641 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.546 ' HE3' ' NE2' ' A' ' 35' ' ' HIS . 31.9 mtpt -103.42 110.48 22.51 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.411 -0.589 . . . . 2.7000000000000002 109.411 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.1 t -88.46 125.13 41.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.262 -0.426 . . . . 1.6200000000000001 110.517 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 32' ' ' SER . 35.2 mm -113.31 123.88 69.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.935 -0.575 . . . . 2.3900000000000001 110.625 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.38 177.53 40.95 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.937 -0.649 . . . . 2.6400000000000001 111.874 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -69.5 -27.76 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.571 0.185 . . . . 3.73 111.31 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -88.7 26.5 1.49 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.752 0.31 . . . . 3.0699999999999998 110.954 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m 61.64 34.77 17.45 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.316 0.579 . . . . 3.25 110.793 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.544 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -84.45 149.02 26.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.764 -0.653 . . . . 2.4700000000000002 110.343 -179.714 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -131.43 120.04 22.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.183 -0.462 . . . . 2.9900000000000002 110.192 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.8 mm -131.55 139.47 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.359 -0.608 . . . . 1.8100000000000001 109.359 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.565 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 20.2 m170 -89.49 140.22 29.75 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.473 -0.566 . . . . 2.04 109.473 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.56 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -127.93 106.55 9.17 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.537 -0.301 . . . . 1.53 111.091 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.441 ' HB2' HG22 ' B' ' 4' ' ' VAL . 5.5 ttmt -79.26 103.49 9.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.116 -0.493 . . . . 2.3999999999999999 109.714 178.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 m -109.38 159.65 8.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.043 0.449 . . . . 1.5700000000000001 111.215 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -104.58 126.28 51.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.058 -0.519 . . . . 3.2000000000000002 109.94 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 57.2 ttp -76.57 84.71 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.102 -0.703 . . . . 3.0099999999999998 109.102 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.3 m 168.52 -36.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.21 108.132 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.5 m -76.26 145.56 39.59 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.168 -0.924 . . . . 1.75 110.603 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -69.76 148.52 49.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.398 -0.365 . . . . 2.4300000000000002 110.723 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.654 ' HA ' HD23 ' A' ' 47' ' ' LEU . 97.1 mt -66.36 -15.07 62.99 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 1.8899999999999999 111.329 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 8.6 tptt -60.03 -39.55 86.26 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.528 -0.545 . . . . 2.4399999999999999 109.528 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -61.45 -42.62 99.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.195 -0.911 . . . . 2.0800000000000001 110.683 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 44' ' ' LEU . 1.8 mm? -66.49 -40.9 89.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.947 -0.569 . . . . 2.54 110.49 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -64.15 -51.07 65.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 2.2599999999999998 112.251 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -63.08 -47.69 81.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.269 0.47 . . . . 1.8799999999999999 112.269 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.584 ' CB ' HD21 ' B' ' 7' ' ' LEU . 67.9 m -65.13 -32.48 74.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.818 0.303 . . . . 1.46 111.818 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.06 -40.21 90.71 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.018 -0.734 . . . . 1.6899999999999999 109.018 179.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 74.4 m -64.39 -38.05 89.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.647 -0.706 . . . . 1.99 109.493 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.523 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 91.1 mt-30 -64.12 -41.39 97.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.772 -0.649 . . . . 2.1699999999999999 110.281 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.44 ' NH1' HG12 ' B' ' 5' ' ' ILE . 26.9 ttt180 -67.65 -38.76 84.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.463 -0.335 . . . . 2.1699999999999999 111.012 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -79.58 -9.92 59.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.53 -0.305 . . . . 2.4100000000000001 111.293 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.09 36.97 56.23 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 121.111 -0.566 . . . . 2.7400000000000002 112.496 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.74 151.55 71.03 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 110.482 -0.192 . . . . 2.6600000000000001 110.482 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -67.07 157.91 59.44 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.844 2.363 . . . . 2.9300000000000002 111.729 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.471 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 16.3 tpt -64.13 143.31 57.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.543 -0.299 . . . . 2.52 111.055 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 59' ' ' MET . 5.0 m120 75.48 1.4 3.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.057 0.762 . . . . 3.6499999999999999 113.057 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.4 p -74.71 -26.48 59.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.238 0.542 . . . . 2.8700000000000001 109.683 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 44.6 mt -119.11 150.11 40.56 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.386 -0.825 . . . . 2.52 110.148 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.0 ptt-85 -113.06 142.13 46.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.005 -0.543 . . . . 3.4700000000000002 109.658 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.402 ' HB3' HD11 ' A' ' 88' ' ' ILE . 80.6 m-85 -108.48 114.4 28.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.214 -0.448 . . . . 2.3999999999999999 109.805 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.6 mt -106.39 123.58 48.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.116 0.484 . . . . 3.2000000000000002 111.406 -178.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -124.5 111.43 15.69 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.679 -0.691 . . . . 2.9700000000000002 109.281 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 61.86 24.56 14.64 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.094 -0.503 . . . . 3.6400000000000001 111.347 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.68 73.56 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.551 -0.833 . . . . 3.75 112.401 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -105.41 134.13 49.03 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.786 -0.449 . . . . 4.6699999999999999 109.786 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.09 131.2 37.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.325 0.584 . . . . 3.5499999999999998 110.025 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.2 mm -68.24 111.47 2.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.536 -0.756 . . . . 2.5499999999999998 111.356 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.51 157.11 24.95 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.144 -0.48 . . . . 2.8900000000000001 110.348 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.415 ' CG ' ' HD3' ' A' ' 45' ' ' LYS . 85.3 m-20 -67.24 -26.34 66.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.114 -0.494 . . . . 2.4399999999999999 111.491 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -93.73 11.81 27.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.348 -0.387 . . . . 3.29 111.46 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.432 ' HB3' HD12 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -91.49 157.02 17.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.123 0.487 . . . . 3.27 110.832 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.576 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -137.48 157.76 73.32 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 2.5299999999999998 110.256 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.91 -19.35 61.99 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.696 2.264 . . . . 2.21 112.636 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -64.63 -35.94 82.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.905 0.383 . . . . 2.9199999999999999 110.888 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.5 pt-20 -94.99 176.88 6.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 3.1800000000000002 110.295 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 81.3 mt 70.13 -9.37 0.74 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.071 0.548 . . . . 3.04 111.906 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 71.1 44.42 54.25 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.923 -0.656 . . . . 2.7599999999999998 111.99 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -70.56 138.62 51.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.505 0.193 . . . . 2.4100000000000001 110.628 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.527 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 42.0 mt-10 -127.42 170.12 12.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.797 0.332 . . . . 3.4399999999999999 110.619 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 20.8 tp10 -69.47 140.9 54.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.912 -0.586 . . . . 2.3399999999999999 109.473 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 31.5 mm-40 70.11 19.87 6.59 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.526 0.516 . . . . 2.5499999999999998 111.261 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.7 OUTLIER -73.82 160.94 30.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.975 -0.38 . . . . 2.2799999999999998 109.975 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 82.5 t -108.44 131.35 59.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.045 0.45 . . . . 2.1899999999999999 111.99 -178.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' A' ' 64' ' ' PHE . 17.2 tt -126.0 131.69 71.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.669 -0.863 . . . . 1.8600000000000001 108.669 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -102.88 137.54 40.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.813 0.339 . . . . 2.8999999999999999 111.7 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 5.4 p -121.2 126.61 75.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 2.3599999999999999 110.295 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -132.64 160.87 35.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.638 0.256 . . . . 2.9399999999999999 111.081 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -81.07 135.53 35.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.264 -0.425 . . . . 3.6299999999999999 110.948 -179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -84.08 148.11 27.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.229 -0.441 . . . . 3.6099999999999999 109.952 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -66.94 -25.92 66.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.423 -0.353 . . . . 4.9199999999999999 111.655 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.27 -33.19 65.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.713 0.292 . . . . 4.4100000000000001 111.455 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.79 5.73 87.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.766 -0.73 . . . . 3.73 112.024 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.868 0 CA-C-O 118.875 -0.958 . . . . 3.6800000000000002 111.91 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 10.4 p . . . . . 0 N--CA 1.446 -0.659 0 CA-C-O 121.279 0.561 . . . . 2.1299999999999999 110.382 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.56 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 5.7 mt -76.38 119.36 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 109.426 -0.583 . . . . 1.6100000000000001 109.426 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -83.54 105.93 14.86 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 120.676 0.274 . . . . 2.5299999999999998 110.617 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.584 HD21 ' CB ' ' A' ' 50' ' ' SER . 0.4 OUTLIER . . . . . 0 C--N 1.315 -0.897 0 CA-C-O 121.138 0.494 . . . . 1.77 110.657 179.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.1 mm . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 109.428 -0.582 . . . . 1.99 109.428 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -93.47 118.66 31.6 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.063 0.459 . . . . 3.0699999999999998 110.938 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 94.0 mt -104.49 150.61 24.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.717 -0.674 . . . . 1.3600000000000001 109.691 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -113.65 113.22 24.73 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.031 0.443 . . . . 2.7000000000000002 111.592 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.439 HG22 ' CG2' ' A' ' 88' ' ' ILE . 60.4 t -96.44 119.37 44.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.22 -0.659 . . . . 1.6200000000000001 109.22 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.524 ' HA ' ' O ' ' A' ' 32' ' ' SER . 25.1 mm -100.62 120.39 50.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 2.3900000000000001 111.555 -178.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.61 171.0 42.92 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.263 -0.735 . . . . 2.6400000000000001 111.263 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.5 tp60 -69.58 -22.82 63.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.126 0.489 . . . . 3.73 110.867 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -85.85 15.26 5.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.977 -0.556 . . . . 3.0699999999999998 110.995 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 65.51 47.31 2.28 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.231 0.539 . . . . 3.25 111.43 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.524 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 13.3 p -111.6 136.06 51.33 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.351 -0.611 . . . . 2.4700000000000002 109.351 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -115.6 94.96 4.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.992 0.425 . . . . 2.9900000000000002 110.559 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.5 mt -91.07 138.56 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.166 -0.47 . . . . 1.8100000000000001 110.235 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.649 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 33.4 m80 -92.12 138.74 31.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.88 -0.6 . . . . 2.04 111.775 -178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.421 ' HZ ' ' CD1' ' A' ' 51' ' ' TYR . 4.4 m-85 -126.17 106.69 9.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.795 -0.639 . . . . 1.53 109.995 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.597 ' HE2' HG21 ' B' ' 4' ' ' VAL . 23.9 mtmt -85.29 96.84 9.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.217 0.532 . . . . 2.3999999999999999 110.89 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.8 m -106.58 171.2 2.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.761 -0.654 . . . . 1.5700000000000001 110.785 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -128.06 141.17 51.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.32 -0.622 . . . . 3.2000000000000002 109.32 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 ttp -77.64 84.9 3.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.387 0.613 . . . . 3.0099999999999998 109.789 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 48.3 m -164.88 -51.59 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.92 -1.036 . . . . 2.21 108.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.34 148.61 32.01 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.825 -1.079 . . . . 1.75 110.313 179.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -67.4 159.16 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.258 -0.428 . . . . 2.4300000000000002 110.616 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.9 mt -69.29 -11.88 61.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.249 0.547 . . . . 1.8899999999999999 109.71 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.46 72.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.198 -0.91 . . . . 2.4399999999999999 109.216 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.5 tptt -60.31 -43.42 96.34 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.102 -0.954 . . . . 2.0800000000000001 110.928 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.471 ' HA ' HD13 ' B' ' 7' ' ' LEU . 3.8 tt -64.8 -33.48 76.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.063 0.458 . . . . 2.54 111.044 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -74.45 -36.7 63.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 2.2599999999999998 112.002 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 0.1 OUTLIER -82.24 -45.82 14.53 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.61 0.596 . . . . 1.8799999999999999 112.61 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 p -58.8 -45.53 89.66 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.328 0.492 . . . . 1.46 112.328 -178.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.421 ' CD1' ' HZ ' ' A' ' 36' ' ' PHE . 6.9 t80 -64.33 -36.2 83.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.72 -0.392 . . . . 1.6899999999999999 111.39 -179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.7 m -61.22 -39.42 90.19 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.091 0.472 . . . . 1.99 109.948 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -63.88 -44.28 93.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.744 . . . . 2.1699999999999999 110.391 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.72 -42.21 91.34 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.973 -0.558 . . . . 2.1699999999999999 110.837 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -69.2 -26.86 65.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.506 -0.315 . . . . 2.4100000000000001 110.903 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.61 33.18 10.4 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.8 -0.714 . . . . 2.7400000000000002 111.84 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 m -133.01 154.3 81.3 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.745 0.307 . . . . 2.6600000000000001 110.5 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.69 149.86 73.82 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.56 2.173 . . . . 2.9300000000000002 111.722 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.525 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 23.1 ttt -68.64 161.66 27.65 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.504 -0.317 . . . . 2.52 110.242 179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 59' ' ' MET . 11.3 m120 78.53 -12.09 1.13 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.512 0.725 . . . . 3.6499999999999999 111.589 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -78.3 -31.24 48.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.341 0.591 . . . . 2.8700000000000001 109.515 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -108.84 131.66 54.77 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.438 -0.801 . . . . 2.52 110.1 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptt-85 -107.99 122.92 47.84 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 3.4700000000000002 110.086 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -88.3 125.11 34.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.964 -0.562 . . . . 2.3999999999999999 109.696 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.4 mt -110.06 131.64 54.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.986 -0.552 . . . . 3.2000000000000002 110.862 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -124.81 106.34 9.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.621 -0.718 . . . . 2.9700000000000002 109.291 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 64.35 33.2 11.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 3.6400000000000001 111.054 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.83 -21.07 45.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.815 -0.707 . . . . 3.75 113.895 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -103.2 138.71 39.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.263 0.531 . . . . 4.6699999999999999 110.565 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -70.47 148.42 48.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.297 0.57 . . . . 3.5499999999999998 111.061 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 29.5 mm -85.22 120.88 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.427 -0.806 . . . . 2.5499999999999998 111.533 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.87 156.52 24.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.962 -0.563 . . . . 2.8900000000000001 109.913 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -70.08 -27.03 64.29 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.267 -0.424 . . . . 2.4399999999999999 111.598 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -87.63 1.23 54.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.309 -0.405 . . . . 3.29 111.234 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.7 m170 -85.16 144.92 27.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.045 0.45 . . . . 3.27 110.858 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.483 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 41.8 p -120.99 161.63 39.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.709 -0.678 . . . . 2.5299999999999998 109.926 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.81 -3.08 7.5 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.666 2.244 . . . . 2.21 112.479 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -79.64 -35.5 39.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.955 -0.566 . . . . 2.9199999999999999 110.37 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 76' ' ' THR . 2.9 pt-20 -94.54 -179.57 4.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.185 -0.462 . . . . 3.1800000000000002 109.992 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.6 mt 73.05 -29.54 0.2 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.327 0.651 . . . . 3.04 111.776 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 94.06 34.58 6.4 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.363 -0.695 . . . . 2.7599999999999998 111.363 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.2 ttm -65.7 128.76 37.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 2.4100000000000001 110.974 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -121.46 -177.65 3.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.987 -0.551 . . . . 3.4399999999999999 110.635 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -75.59 144.52 41.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.149 -0.478 . . . . 2.3399999999999999 110.275 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 62.1 27.05 16.31 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.582 0.551 . . . . 2.5499999999999998 110.584 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.68 140.64 40.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.544 . . . . 2.2799999999999998 110.602 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.403 HG13 HG12 ' A' ' 27' ' ' ILE . 54.8 t -90.38 127.28 42.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.708 -0.678 . . . . 2.1899999999999999 111.631 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.439 ' CG2' HG22 ' A' ' 26' ' ' VAL . 19.3 tt -125.68 139.97 49.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.61 -0.885 . . . . 1.8600000000000001 108.61 178.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -104.86 157.99 16.83 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.992 0.425 . . . . 2.8999999999999999 111.444 -178.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 p -141.19 121.91 12.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 2.3599999999999999 110.418 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -128.55 161.7 28.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.029 -0.532 . . . . 2.9399999999999999 109.711 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -92.42 138.41 31.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 3.6299999999999999 110.955 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -72.36 142.67 48.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.892 -0.595 . . . . 3.6099999999999999 110.019 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -66.98 -34.41 77.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.393 -0.367 . . . . 4.9199999999999999 110.597 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -35.52 80.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.019 -0.537 . . . . 4.4100000000000001 111.408 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.24 -27.68 15.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.842 -0.694 . . . . 3.73 111.902 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.874 0 CA-C-O 118.88 -0.955 . . . . 3.6800000000000002 111.749 179.745 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.649 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 7.4 p . . . . . 0 N--CA 1.441 -0.89 0 N-CA-C 109.278 -0.638 . . . . 2.1299999999999999 109.278 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -90.58 109.61 21.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.829 -0.623 . . . . 1.6100000000000001 110.757 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . 0.41 ' HA ' ' O ' ' A' ' 37' ' ' LYS . 1.8 m-20 -76.46 117.95 18.64 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 116.058 -0.519 . . . . 2.5299999999999998 109.757 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 47' ' ' LEU . 13.1 mt . . . . . 0 C--N 1.313 -0.997 0 CA-C-O 121.45 0.643 . . . . 1.77 110.033 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.3 mm . . . . . 0 CA--C 1.52 -0.204 0 N-CA-C 110.118 -0.327 . . . . 1.99 110.118 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 tttt -103.39 119.76 39.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.164 0.507 . . . . 3.0699999999999998 111.364 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.0 mt -106.33 150.25 26.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.561 -0.745 . . . . 1.3600000000000001 109.537 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -104.74 106.57 17.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.432 -0.349 . . . . 2.7000000000000002 110.581 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.01 123.02 37.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.202 -0.666 . . . . 1.6200000000000001 109.202 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 89' ' ' GLU . 48.1 mm -117.92 108.57 24.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.013 0.435 . . . . 2.3900000000000001 110.625 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.28 170.13 50.42 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.582 -0.818 . . . . 2.6400000000000001 111.29 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -64.99 -27.69 69.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.14 0.495 . . . . 3.73 110.731 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.15 25.41 1.87 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.686 -0.688 . . . . 3.0699999999999998 111.411 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.8 m 60.11 33.84 21.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.167 0.508 . . . . 3.25 111.839 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.42 114.11 23.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.991 -0.55 . . . . 2.4700000000000002 109.739 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -101.37 108.75 20.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.609 -0.515 . . . . 2.9900000000000002 109.609 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.8 mm -115.66 144.43 23.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.567 0.223 . . . . 1.8100000000000001 110.41 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -89.06 141.78 28.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.916 0.389 . . . . 2.04 110.391 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.491 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -133.79 104.41 6.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 1.53 111.063 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.404 ' CE ' HG11 ' B' ' 4' ' ' VAL . 4.7 mtmt -91.01 106.75 18.74 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.254 0.55 . . . . 2.3999999999999999 110.982 178.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.45 HG11 HD23 ' A' ' 47' ' ' LEU . 18.0 m -111.83 170.46 3.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.689 -0.687 . . . . 1.5700000000000001 111.249 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.483 ' HE2' ' OG1' ' A' ' 42' ' ' THR . 16.1 pttm -119.16 138.67 52.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.989 -0.55 . . . . 3.2000000000000002 109.922 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 42.7 tpp -75.1 84.71 2.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.125 0.488 . . . . 3.0099999999999998 110.141 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.3 -55.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 2.21 109.369 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.483 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 0.8 OUTLIER -79.09 147.64 32.7 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.126 -0.943 . . . . 1.75 110.841 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -70.19 173.51 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.236 -0.653 . . . . 2.4300000000000002 109.236 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.01 3.89 6.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.246 0.546 . . . . 1.8899999999999999 110.139 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.4 tptt -60.24 -46.2 90.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.102 -0.953 . . . . 2.4399999999999999 109.208 177.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -65.24 -38.48 90.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.888 -1.051 . . . . 2.0800000000000001 110.037 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.45 HD23 HG11 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -53.93 -46.15 71.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.815 -0.63 . . . . 2.54 110.581 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 53.7 mtpt -70.05 -54.67 12.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.725 -0.67 . . . . 2.2599999999999998 112.647 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -43.62 79.79 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.198 0.814 . . . . 1.8799999999999999 113.198 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.8 m -63.47 -37.1 86.0 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.327 -0.233 . . . . 1.46 111.537 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -67.17 -43.68 81.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.636 -0.426 . . . . 1.6899999999999999 109.915 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.66 -37.65 82.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.01 0.433 . . . . 1.99 110.303 179.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -60.39 -43.08 96.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.825 -0.625 . . . . 2.1699999999999999 110.518 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.18 -28.78 61.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.326 -0.397 . . . . 2.1699999999999999 110.888 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -74.92 -19.68 60.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.511 -0.313 . . . . 2.4100000000000001 111.184 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.64 25.38 42.5 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.609 -0.805 . . . . 2.7400000000000002 112.288 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 7.0 m -127.73 154.7 77.91 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 110.07 -0.345 . . . . 2.6600000000000001 110.07 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.38 161.91 44.28 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.283 1.988 . . . . 2.9300000000000002 111.771 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.06 153.36 43.9 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.292 -0.413 . . . . 2.52 110.664 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t30 74.96 5.97 4.32 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.612 0.765 . . . . 3.6499999999999999 112.069 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.5 p -88.81 -26.01 21.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.263 0.554 . . . . 2.8700000000000001 109.698 178.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -115.5 146.22 41.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.47 -0.786 . . . . 2.52 110.24 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.5 ptt-85 -119.0 133.99 55.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.401 -0.592 . . . . 3.4700000000000002 109.401 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 96.2 m-85 -102.65 128.05 49.5 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.069 -0.514 . . . . 2.3999999999999999 109.906 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.9 mt -110.35 133.45 53.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.378 0.609 . . . . 3.2000000000000002 111.546 -179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -124.95 105.55 9.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.106 -0.952 . . . . 2.9700000000000002 108.508 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 63.95 22.68 13.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.862 -0.608 . . . . 3.6400000000000001 110.87 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.17 -25.75 26.13 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.973 -0.632 . . . . 3.75 112.678 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -87.36 143.07 27.43 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.099 -0.334 . . . . 4.6699999999999999 110.099 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -82.16 140.33 33.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.257 0.551 . . . . 3.5499999999999998 110.706 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.6 mm -78.56 116.14 21.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.559 -0.746 . . . . 2.5499999999999998 111.082 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.57 26.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.016 -0.538 . . . . 2.8900000000000001 110.39 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.426 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.1 m-20 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.227 -0.442 . . . . 2.4399999999999999 111.222 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -92.21 -2.52 56.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.498 -0.319 . . . . 3.29 111.68 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.2 m170 -67.35 143.89 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.765 0.317 . . . . 3.27 110.877 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 75.6 p -120.27 155.84 55.67 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 116.307 -0.406 . . . . 2.5299999999999998 110.615 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.01 -11.05 28.69 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.39 2.06 . . . . 2.21 111.212 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -78.89 -38.92 36.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.504 -0.771 . . . . 2.9199999999999999 110.274 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 10.0 pt-20 -86.49 -179.15 6.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.462 -0.335 . . . . 3.1800000000000002 110.41 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 9.0 mt 72.07 -54.75 0.68 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.225 0.61 . . . . 3.04 111.674 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.85 36.36 0.67 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.673 -0.571 . . . . 2.7599999999999998 111.673 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.07 132.37 45.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.9 0.381 . . . . 2.4100000000000001 110.453 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -124.79 -168.74 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.12 0.486 . . . . 3.4399999999999999 111.485 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -76.24 143.76 40.79 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.518 -0.764 . . . . 2.3399999999999999 109.681 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 60.59 28.12 17.81 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.421 . . . . 2.5499999999999998 110.893 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.92 147.15 43.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 2.2799999999999998 110.153 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 17.6 t -96.09 128.32 47.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.234 0.54 . . . . 2.1899999999999999 111.708 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.8 tt -125.57 112.81 32.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.742 -0.836 . . . . 1.8600000000000001 108.742 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 27' ' ' ILE . 75.8 mt-10 -88.64 141.45 28.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.736 -0.666 . . . . 2.8999999999999999 111.181 -178.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.41 137.52 53.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.075 -0.511 . . . . 2.3599999999999999 110.349 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -137.12 163.36 31.01 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.557 -0.534 . . . . 2.9399999999999999 109.557 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -95.81 139.43 32.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.686 0.279 . . . . 3.6299999999999999 110.48 -179.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -79.17 149.34 32.01 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 3.6099999999999999 110.289 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -58.59 -45.5 88.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 4.9199999999999999 110.841 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.7 p -72.05 -32.75 67.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.056 -0.52 . . . . 4.4100000000000001 110.277 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.73 15.04 70.78 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.682 -0.69 . . . . 3.73 112.296 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.936 0 N-CA-C 110.922 -0.871 . . . . 3.6800000000000002 110.922 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.404 HG11 ' CE ' ' A' ' 37' ' ' LYS . 15.0 p . . . . . 0 N--CA 1.443 -0.776 0 CA-C-O 121.433 0.635 . . . . 2.1299999999999999 110.94 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.491 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 18.4 mt -87.55 108.52 18.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.828 -0.624 . . . . 1.6100000000000001 109.502 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . 0.422 ' O ' HD23 ' B' ' 7' ' ' LEU . 22.8 m-20 -79.67 134.42 36.42 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.79 -0.448 . . . . 2.5299999999999998 109.79 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.422 HD23 ' O ' ' B' ' 6' ' ' ASP . 18.2 mt . . . . . 0 C--N 1.32 -0.68 0 CA-C-O 121.479 0.657 . . . . 1.77 109.989 178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.9 mm . . . . . 0 N--CA 1.456 -0.171 0 N-CA-C 109.994 -0.373 . . . . 1.99 109.994 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 35.6 ttpt -112.43 118.59 35.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.442 -0.345 . . . . 3.0699999999999998 110.204 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.3 mt -102.67 150.29 23.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.334 -0.394 . . . . 1.3600000000000001 110.039 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -107.82 111.45 23.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.782 0.325 . . . . 2.7000000000000002 111.173 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 20.2 t -90.06 104.35 15.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.129 -0.693 . . . . 1.6200000000000001 109.129 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.76 114.93 30.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.066 0.46 . . . . 2.3900000000000001 111.47 -178.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 170.05 34.56 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.771 -0.65 . . . . 2.6400000000000001 111.949 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -71.85 -16.59 62.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.135 0.493 . . . . 3.73 110.9 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -91.69 15.03 13.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.486 . . . . 3.0699999999999998 110.747 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.9 m 68.14 30.17 5.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.582 -0.735 . . . . 3.25 111.708 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 55.7 p -99.18 140.69 32.96 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.494 -0.558 . . . . 2.4700000000000002 109.494 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.429 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 5.0 pt-20 -125.71 92.57 3.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.133 0.492 . . . . 2.9900000000000002 110.939 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 6.6 mm -81.22 139.3 18.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.767 -0.827 . . . . 1.8100000000000001 108.767 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.414 ' HB3' HG13 ' B' ' 4' ' ' VAL . 2.2 m-70 -95.64 147.61 23.4 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.871 -0.332 . . . . 2.04 110.32 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.602 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -125.62 117.11 22.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.324 -0.398 . . . . 1.53 111.164 -179.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.46 ' N ' HG12 ' B' ' 4' ' ' VAL . 3.6 mtmt -96.68 96.11 8.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.136 0.493 . . . . 2.3999999999999999 110.818 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.447 HG12 ' HB2' ' B' ' 7' ' ' LEU . 16.2 m -118.29 170.88 7.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.733 . . . . 1.5700000000000001 111.35 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.89 147.0 50.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.932 -0.766 . . . . 3.2000000000000002 108.932 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.654 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 23.1 mmt -69.39 86.2 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.209 0.528 . . . . 3.0099999999999998 110.672 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.1 m -164.53 -52.32 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.529 -0.76 . . . . 2.21 109.622 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.05 147.66 34.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.261 -0.881 . . . . 1.75 111.484 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -69.37 165.58 20.46 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.154 -0.475 . . . . 2.4300000000000002 110.586 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.483 HD13 HD12 ' A' ' 71' ' ' ILE . 53.2 mt -70.99 -9.92 58.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.149 0.499 . . . . 1.8899999999999999 110.564 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG3' ' OD2' ' A' ' 73' ' ' ASP . 40.3 tttp -63.49 -38.01 89.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.236 -0.653 . . . . 2.4399999999999999 109.236 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -61.76 -36.38 80.87 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.316 -0.857 . . . . 2.0800000000000001 110.218 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.21 -39.52 94.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.603 -0.726 . . . . 2.54 110.391 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -70.6 -52.45 21.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.38 -0.827 . . . . 2.2599999999999998 112.206 -178.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.476 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 4.4 pt-20 -65.27 -47.04 78.08 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.884 0.698 . . . . 1.8799999999999999 112.884 -177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.462 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 13.0 m -59.79 -39.26 84.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.711 0.291 . . . . 1.46 111.777 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.407 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 21.3 t80 -69.28 -41.06 77.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.632 -0.427 . . . . 1.6899999999999999 110.298 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.72 -40.78 96.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.327 -0.397 . . . . 1.99 110.634 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 92.9 mt-30 -62.07 -41.78 98.52 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.226 0.536 . . . . 2.1699999999999999 109.955 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.457 ' NH1' HG12 ' B' ' 5' ' ' ILE . 23.4 ttt180 -64.86 -43.81 91.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.846 -0.615 . . . . 2.1699999999999999 110.573 179.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 13.5 mm100 -69.39 -25.33 64.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 2.4100000000000001 110.466 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.71 40.36 8.28 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 111.224 -0.75 . . . . 2.7400000000000002 111.224 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.4 m -135.99 155.75 77.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.292 . . . . 2.6600000000000001 110.21 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.45 148.46 92.62 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.87 2.38 . . . . 2.9300000000000002 112.126 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.476 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 12.6 ttt -76.44 61.32 1.7 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.498 0.666 . . . . 2.52 110.883 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.419 ' H ' ' H ' ' A' ' 61' ' ' SER . 1.9 t-20 -170.1 -18.36 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.446 -0.797 . . . . 3.6499999999999999 109.735 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.419 ' H ' ' H ' ' A' ' 60' ' ' ASN . 1.4 m -82.31 -12.05 58.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 2.8700000000000001 111.583 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 64.2 mt -121.64 139.32 53.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.05 0.453 . . . . 2.52 111.177 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.406 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 19.9 ptt-85 -118.15 129.0 55.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.993 -0.549 . . . . 3.4700000000000002 109.565 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -97.68 126.98 43.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.982 -0.553 . . . . 2.3999999999999999 110.309 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 81.9 mt -113.88 137.12 52.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 3.2000000000000002 110.851 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -127.17 100.38 6.07 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.495 -0.928 . . . . 2.9700000000000002 108.495 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 65.55 31.79 9.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.634 -0.712 . . . . 3.6400000000000001 110.555 -179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.74 -28.04 15.24 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.733 -0.667 . . . . 3.75 112.701 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -87.71 135.4 33.39 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.225 -0.287 . . . . 4.6699999999999999 110.225 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -75.56 142.16 42.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.469 0.652 . . . . 3.5499999999999998 111.328 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.483 HD12 HD13 ' A' ' 44' ' ' LEU . 30.3 mm -79.59 117.38 25.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.268 -0.878 . . . . 2.5499999999999998 110.925 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.45 ' HB3' ' ND1' ' A' ' 75' ' ' HIS . . . -84.81 154.9 22.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.048 -0.524 . . . . 2.8900000000000001 110.229 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.412 ' OD2' ' HG3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -66.99 -27.75 67.69 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.993 -0.548 . . . . 2.4399999999999999 111.744 -179.051 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -89.4 4.25 49.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 3.29 111.503 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.45 ' ND1' ' HB3' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -86.37 149.16 25.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.336 0.589 . . . . 3.27 111.378 -179.35 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.1 p -117.42 157.95 46.11 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.502 -0.772 . . . . 2.5299999999999998 110.09 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . 0.654 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 17.0 Cg_exo -67.0 -10.71 29.54 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.441 2.094 . . . . 2.21 111.952 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -79.46 -17.56 53.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.366 0.603 . . . . 2.9199999999999999 109.79 179.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -98.01 164.14 12.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.661 -0.699 . . . . 3.1800000000000002 110.26 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 86.6 mt 68.68 -1.13 2.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.888 -0.597 . . . . 3.04 111.944 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.07 45.53 55.96 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.81 -0.71 . . . . 2.7599999999999998 112.868 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 3.6 ttt -72.53 125.4 27.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.811 0.338 . . . . 2.4100000000000001 110.229 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -114.18 -171.53 1.93 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.467 0.543 . . . . 3.4399999999999999 112.467 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.94 137.45 45.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.499 -0.773 . . . . 2.3399999999999999 110.229 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 54.76 38.7 30.61 Favored 'General case' 0 CA--C 1.516 -0.348 0 O-C-N 123.797 0.686 . . . . 2.5499999999999998 110.863 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.02 160.11 33.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.609 -0.723 . . . . 2.2799999999999998 110.404 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 99.3 t -99.16 114.06 35.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.394 0.616 . . . . 2.1899999999999999 112.208 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -120.32 132.31 70.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 108.277 -1.008 . . . . 1.8600000000000001 108.277 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -111.66 144.05 41.57 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.916 0.389 . . . . 2.8999999999999999 111.28 -178.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.62 129.54 73.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.078 -0.51 . . . . 2.3599999999999999 110.421 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -130.92 159.72 36.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.23 -0.441 . . . . 2.9399999999999999 110.121 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -79.95 139.59 37.0 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.864 0.364 . . . . 3.6299999999999999 111.026 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.406 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.4 mm-40 -77.38 149.83 35.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.914 -0.585 . . . . 3.6099999999999999 110.855 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -73.17 -32.68 64.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.874 -0.603 . . . . 4.9199999999999999 110.317 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 p -65.18 -57.18 9.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.908 -0.587 . . . . 4.4100000000000001 110.128 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.35 -20.31 18.82 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.756 -0.656 . . . . 3.73 112.493 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.75 -1.028 . . . . 3.6800000000000002 111.807 -179.904 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.46 HG12 ' N ' ' A' ' 37' ' ' LYS . 2.2 t . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 109.671 -0.492 . . . . 2.1299999999999999 109.671 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.483 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 9.6 mt -71.77 108.71 3.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 1.6100000000000001 109.707 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -73.94 107.6 6.26 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 116.157 -0.474 . . . . 2.5299999999999998 110.466 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.447 ' HB2' HG12 ' A' ' 38' ' ' VAL . 12.0 mt . . . . . 0 C--N 1.314 -0.947 0 C-N-CA 119.455 -0.898 . . . . 1.77 109.966 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm . . . . . 0 C--O 1.232 0.163 0 N-CA-C 109.622 -0.51 . . . . 1.99 109.622 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.712 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -102.5 145.84 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.157 0.503 . . . . 3.0699999999999998 111.689 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.0 mt -131.0 128.86 41.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.493 -0.776 . . . . 1.3600000000000001 109.26 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -93.78 109.91 21.57 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.847 0.356 . . . . 2.7000000000000002 110.464 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 12.4 t -85.55 123.2 39.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.6200000000000001 110.747 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.6 mm -109.93 116.7 52.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.685 -0.689 . . . . 2.3900000000000001 110.117 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.65 -179.93 43.33 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 2.6400000000000001 112.275 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -65.88 -28.48 68.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 3.73 110.617 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -86.21 13.56 7.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.107 -0.497 . . . . 3.0699999999999998 110.606 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m 59.78 48.63 8.93 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.833 0.825 . . . . 3.25 110.327 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.57 166.42 16.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.954 -1.021 . . . . 2.4700000000000002 109.815 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -137.53 97.07 3.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.023 0.44 . . . . 2.9900000000000002 110.243 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.7 mm -116.23 127.63 73.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.554 . . . . 1.8100000000000001 109.58 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.644 ' HB3' HG13 ' B' ' 4' ' ' VAL . 0.0 OUTLIER -88.81 166.67 13.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.141 0.495 . . . . 2.04 110.826 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.712 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -143.39 131.11 21.36 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 122.246 -0.284 . . . . 1.53 111.71 -179.062 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -99.09 95.2 6.96 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.061 -0.348 . . . . 2.3999999999999999 110.061 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.9 m -117.35 171.58 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 1.5700000000000001 111.465 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.63 148.35 50.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.542 -0.54 . . . . 3.2000000000000002 109.542 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 mtt -83.96 85.33 7.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.225 0.536 . . . . 3.0099999999999998 111.032 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 16.3 m -167.74 -46.9 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.294 -1.002 . . . . 2.21 108.294 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.52 148.07 37.35 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.716 -1.129 . . . . 1.75 110.882 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.431 ' HA ' HG22 ' A' ' 76' ' ' THR . 1.4 m-70 -66.67 155.27 38.43 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.295 -0.412 . . . . 2.4300000000000002 110.648 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.8 mt -69.5 -9.96 56.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.449 . . . . 1.8899999999999999 110.3 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.553 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 17.8 ttpp -61.51 -40.23 93.87 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.486 -0.779 . . . . 2.4399999999999999 109.103 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.3 tptp -62.6 -39.87 95.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.349 -0.841 . . . . 2.0800000000000001 109.95 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.13 -44.39 87.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 2.54 110.201 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -68.88 -54.59 14.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.604 -0.726 . . . . 2.2599999999999998 112.356 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.4 pt-20 -62.67 -42.58 99.69 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.788 0.662 . . . . 1.8799999999999999 112.788 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.501 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 9.4 m -65.67 -34.54 78.45 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.816 -0.354 . . . . 1.46 111.22 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.49 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 7.0 t80 -70.87 -40.69 72.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.525 -0.546 . . . . 1.6899999999999999 109.525 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 79.8 m -61.5 -35.22 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 1.99 109.896 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.501 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 72.8 mt-30 -63.44 -38.12 89.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.69 -0.686 . . . . 2.1699999999999999 110.363 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.445 ' NH1' HG12 ' B' ' 5' ' ' ILE . 2.4 ttt180 -76.05 -38.45 57.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.367 -0.379 . . . . 2.1699999999999999 110.334 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 10.8 mm100 -69.61 -22.79 63.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.063 0.459 . . . . 2.4100000000000001 110.251 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.28 27.24 40.69 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.005 -0.617 . . . . 2.7400000000000002 112.506 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.2 m -117.56 153.13 50.36 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.547 0.213 . . . . 2.6600000000000001 110.814 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.79 173.97 11.1 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.399 2.066 . . . . 2.9300000000000002 111.836 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.4 tpt -74.57 148.94 40.37 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.649 -0.25 . . . . 2.52 110.753 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 70.06 16.72 7.48 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.636 -0.711 . . . . 3.6499999999999999 112.167 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.5 p -92.42 -26.62 17.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.242 0.544 . . . . 2.8700000000000001 109.698 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.7 mt -121.22 146.28 46.96 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.579 -0.737 . . . . 2.52 110.227 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.444 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.5 ptt-85 -119.3 131.26 55.72 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.142 -0.688 . . . . 3.4700000000000002 109.142 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.1 m-85 -99.87 133.83 43.66 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.964 -0.562 . . . . 2.3999999999999999 110.675 -178.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.7 mt -115.89 131.74 56.85 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.961 -0.563 . . . . 3.2000000000000002 110.665 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -134.97 114.49 12.55 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.424 -0.807 . . . . 2.9700000000000002 109.069 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 62.98 23.2 13.89 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.09 0.472 . . . . 3.6400000000000001 110.798 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.42 -12.55 68.74 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.953 -0.642 . . . . 3.75 112.452 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -103.51 138.48 40.16 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.663 -0.316 . . . . 4.6699999999999999 110.279 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.2 ptm180 -76.28 142.37 41.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.136 0.493 . . . . 3.5499999999999998 110.476 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.3 mm -75.75 117.8 20.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.798 -0.637 . . . . 2.5499999999999998 111.811 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.32 157.39 18.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.663 -0.698 . . . . 2.8900000000000001 109.64 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -67.85 -29.08 68.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.317 0.58 . . . . 2.4399999999999999 110.629 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -82.73 -4.42 57.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.697 -0.683 . . . . 3.29 111.177 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -81.76 145.46 30.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.105 0.479 . . . . 3.27 111.058 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 21.1 p -127.47 161.07 56.98 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 2.5299999999999998 109.7 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -65.39 -11.5 30.55 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.367 2.045 . . . . 2.21 111.923 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.41 -36.17 71.24 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.829 -0.623 . . . . 2.9199999999999999 110.313 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 4.2 pt-20 -97.95 -178.68 4.16 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.433 -0.581 . . . . 3.1800000000000002 109.433 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 23.7 mt 73.92 -49.94 0.68 Allowed 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.666 0.604 . . . . 3.04 110.896 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.06 50.74 0.62 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.998 -0.62 . . . . 2.7599999999999998 112.137 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 33.3 mtt -77.39 137.23 38.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.36 . . . . 2.4100000000000001 110.778 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -122.79 174.13 7.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.11 -0.496 . . . . 3.4399999999999999 110.465 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -63.98 129.03 38.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 2.3399999999999999 110.898 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 58.26 49.36 11.26 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.295 0.569 . . . . 2.5499999999999998 110.879 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -79.31 178.58 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.652 -0.703 . . . . 2.2799999999999998 110.232 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.3 t -117.74 131.79 69.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.834 0.35 . . . . 2.1899999999999999 111.181 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 17.0 tt -134.81 132.5 53.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.288 -0.634 . . . . 1.8600000000000001 109.288 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -98.42 151.69 20.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.77 0.319 . . . . 2.8999999999999999 111.466 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -131.32 127.02 59.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.045 -0.525 . . . . 2.3599999999999999 110.353 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.05 160.54 35.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.949 -0.569 . . . . 2.9399999999999999 109.823 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -85.65 145.55 27.26 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.874 0.368 . . . . 3.6299999999999999 110.945 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.444 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.2 mm-40 -84.62 133.27 34.42 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.179 -0.464 . . . . 3.6099999999999999 110.91 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -64.6 -28.47 69.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.859 -0.61 . . . . 4.9199999999999999 110.353 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -15.87 63.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 4.4100000000000001 111.458 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.07 -55.04 3.28 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.004 -0.617 . . . . 3.73 112.104 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.627 -1.096 . . . . 3.6800000000000002 111.518 179.903 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.644 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.614 0 N-CA-C 109.879 -0.415 . . . . 2.1299999999999999 109.879 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.589 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 23.4 mt -69.93 122.0 20.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 109.073 -0.714 . . . . 1.6100000000000001 109.073 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -70.26 106.71 3.43 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.688 -0.687 . . . . 2.5299999999999998 111.836 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 8.4 mt . . . . . 0 C--N 1.319 -0.733 0 N-CA-C 109.502 -0.555 . . . . 1.77 109.502 177.711 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.428 ' O ' HG22 ' A' ' 38' ' ' VAL . 45.1 mm . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.913 0.387 . . . . 1.99 110.901 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -110.23 126.81 54.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.872 0.368 . . . . 3.0699999999999998 110.62 179.124 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 71.9 mt -104.38 132.77 50.26 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.242 -0.651 . . . . 1.3600000000000001 109.242 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 86' ' ' ASP . 1.7 ptpm? -99.5 113.42 25.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 2.7000000000000002 110.598 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.648 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.2 t -83.41 121.1 35.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.064 -0.971 . . . . 1.6200000000000001 110.003 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.533 ' HA ' ' O ' ' A' ' 32' ' ' SER . 43.2 mm -105.78 124.76 61.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.254 -0.43 . . . . 2.3900000000000001 110.946 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.4 178.82 35.76 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.826 -0.624 . . . . 2.6400000000000001 112.187 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -70.01 -31.03 68.49 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 3.73 111.03 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -87.61 24.46 1.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.937 0.399 . . . . 3.0699999999999998 111.085 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.5 m 62.01 37.96 14.51 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.636 -0.711 . . . . 3.25 111.649 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.533 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 1.2 p -91.07 145.96 24.25 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.212 -0.449 . . . . 2.4700000000000002 110.363 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -127.76 118.8 24.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.978 0.418 . . . . 2.9900000000000002 110.315 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.2 mt -120.27 130.57 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 1.8100000000000001 109.482 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.668 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 14.6 m170 -88.21 148.53 24.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.508 . . . . 2.04 110.987 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -133.65 113.09 11.99 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.135 -0.484 . . . . 1.53 110.852 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.445 ' HB2' HG22 ' B' ' 4' ' ' VAL . 6.1 ttmt -81.36 101.42 9.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 2.3999999999999999 110.431 179.081 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.428 HG22 ' O ' ' A' ' 22' ' ' ILE . 5.3 m -108.06 156.88 8.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.361 . . . . 1.5700000000000001 110.718 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -113.83 129.66 56.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.193 -0.458 . . . . 3.2000000000000002 109.89 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.7 ttp -71.44 85.53 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.287 0.565 . . . . 3.0099999999999998 110.263 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 21.8 m -165.04 -59.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.33 -0.85 . . . . 2.21 109.082 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 149.45 29.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.346 -0.843 . . . . 1.75 111.134 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.71 -178.92 2.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.154 -0.475 . . . . 2.4300000000000002 110.37 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.406 HD13 HG23 ' A' ' 71' ' ' ILE . 1.5 mt -78.34 -3.37 42.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.438 -0.346 . . . . 1.8899999999999999 111.27 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -61.73 -53.24 58.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.991 0.424 . . . . 2.4399999999999999 110.179 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -65.43 -36.16 83.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.874 -0.603 . . . . 2.0800000000000001 110.721 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.62 -43.34 99.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.916 -0.583 . . . . 2.54 111.274 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -66.64 -50.34 63.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.209 0.448 . . . . 2.2599999999999998 112.209 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.4 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 6.7 pt-20 -64.55 -43.53 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.68 0.622 . . . . 1.8799999999999999 112.68 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 m -64.62 -33.07 75.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.61 0.243 . . . . 1.46 111.361 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -68.6 -42.46 78.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.907 -0.405 . . . . 1.6899999999999999 109.907 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.34 -35.33 78.76 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 1.99 110.809 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.4 -35.85 82.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 2.1699999999999999 110.453 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -72.17 -34.54 68.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 2.1699999999999999 110.76 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -81.31 -13.62 58.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 2.4100000000000001 110.497 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.09 39.67 44.64 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.163 -0.542 . . . . 2.7400000000000002 112.63 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.6 m -137.5 156.0 75.14 Favored Pre-proline 0 C--N 1.328 -0.351 0 N-CA-C 110.408 -0.219 . . . . 2.6600000000000001 110.408 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.31 146.8 90.61 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.666 2.244 . . . . 2.9300000000000002 112.645 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.4 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 5.2 ttt -78.5 55.29 1.59 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.892 -0.594 . . . . 2.52 111.097 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -156.87 -16.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.112 -0.494 . . . . 3.6499999999999999 111.167 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.7 p -96.62 -8.61 31.25 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.119 -0.232 . . . . 2.8700000000000001 111.256 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 23.0 mt -115.35 126.74 54.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.9 0.381 . . . . 2.52 110.633 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.1 ptt-85 -115.06 128.67 56.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 3.4700000000000002 110.019 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -96.14 132.78 41.19 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.785 -0.643 . . . . 2.3999999999999999 109.65 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.5 mt -118.29 142.58 47.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.027 0.442 . . . . 3.2000000000000002 111.319 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -135.43 107.06 6.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.278 -0.874 . . . . 2.9700000000000002 109.034 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 61.09 34.04 19.26 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.052 0.454 . . . . 3.6400000000000001 111.175 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.57 -19.76 42.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.018 -0.611 . . . . 3.75 112.759 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -89.9 133.86 34.53 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.15 -0.315 . . . . 4.6699999999999999 110.15 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.1 ptm85 -77.76 138.4 38.99 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.299 -0.56 . . . . 3.5499999999999998 110.324 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.406 HG23 HD13 ' A' ' 44' ' ' LEU . 42.3 mm -79.27 111.35 16.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.648 -0.706 . . . . 2.5499999999999998 111.267 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.29 162.77 22.17 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 2.8900000000000001 109.832 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.88 -30.85 71.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.862 -0.608 . . . . 2.4399999999999999 111.476 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -82.84 4.22 26.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 3.29 112.031 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -81.05 164.96 22.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.826 0.346 . . . . 3.27 110.841 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.429 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 8.9 t -155.77 146.21 16.03 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.438 -0.579 . . . . 2.5299999999999998 109.438 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.56 -17.07 16.0 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.953 2.435 . . . . 2.21 112.927 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -73.32 -15.83 61.38 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.228 -0.442 . . . . 2.9199999999999999 110.787 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 12.5 pt-20 -119.38 171.4 8.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 3.1800000000000002 109.496 178.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 92.2 mt 73.13 -3.23 2.5 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.668 0.605 . . . . 3.04 111.153 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.81 47.3 40.58 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 121.033 -0.604 . . . . 2.7599999999999998 113.053 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 10.1 mtt -73.2 131.57 42.16 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.858 -0.423 . . . . 2.4100000000000001 109.858 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 46.1 mt-10 -119.93 178.7 4.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.068 0.461 . . . . 3.4399999999999999 111.606 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -67.92 138.83 56.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.483 -0.78 . . . . 2.3399999999999999 110.535 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 57.59 39.05 27.98 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.593 0.558 . . . . 2.5499999999999998 110.641 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 25' ' ' LYS . 1.0 OUTLIER -77.47 164.76 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.015 -0.538 . . . . 2.2799999999999998 110.39 -179.803 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.0 t -103.19 132.86 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.144 0.497 . . . . 2.1899999999999999 111.877 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.648 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -132.98 127.82 55.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.691 -0.855 . . . . 1.8600000000000001 108.691 178.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -103.89 142.14 34.92 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.69 0.281 . . . . 2.8999999999999999 111.036 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.9 p -121.43 126.96 75.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.162 0.506 . . . . 2.3599999999999999 110.206 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -130.72 165.46 22.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.896 -0.593 . . . . 2.9399999999999999 109.693 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -96.24 139.05 32.95 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.943 0.402 . . . . 3.6299999999999999 110.906 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.92 146.5 39.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.873 -0.603 . . . . 3.6099999999999999 109.584 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -69.42 -25.7 64.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.433 -0.349 . . . . 4.9199999999999999 111.303 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.93 -18.51 62.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.232 -0.44 . . . . 4.4100000000000001 111.437 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.88 -1.27 79.77 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.809 -0.71 . . . . 3.73 112.593 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.944 -0.92 . . . . 3.6800000000000002 111.337 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.668 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 12.2 p . . . . . 0 N--CA 1.442 -0.826 0 CA-C-O 122.062 0.934 . . . . 2.1299999999999999 110.624 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.446 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 6.4 mt -77.81 117.2 22.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 114.607 -1.179 . . . . 1.6100000000000001 109.859 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.29 106.31 8.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.805 0.336 . . . . 2.5299999999999998 110.909 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.413 HD22 ' CZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER . . . . . 0 C--N 1.314 -0.96 0 CA-C-O 121.521 0.676 . . . . 1.77 109.346 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mm . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.547 0.213 . . . . 1.99 111.204 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -121.28 119.27 31.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.343 -0.389 . . . . 3.0699999999999998 110.046 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 87.1 mt -103.51 144.59 31.21 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.221 -0.445 . . . . 1.3600000000000001 110.0 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 mttp -99.81 103.08 14.68 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.313 -0.403 . . . . 2.7000000000000002 110.625 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 11.0 t -88.03 124.94 41.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.922 -0.581 . . . . 1.6200000000000001 109.534 179.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 32' ' ' SER . 10.8 mm -119.37 137.41 53.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.014 0.435 . . . . 2.3900000000000001 111.533 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -112.18 172.76 14.96 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.923 -0.58 . . . . 2.6400000000000001 111.969 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 31.6 tp60 -65.52 -20.36 66.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.166 0.507 . . . . 3.73 111.325 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -89.31 18.42 5.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.389 -0.369 . . . . 3.0699999999999998 110.678 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.4 m 59.36 39.93 21.64 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.67 -0.696 . . . . 3.25 111.239 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 2.0 p -91.01 142.86 27.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.766 -0.652 . . . . 2.4700000000000002 110.174 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -121.97 114.69 21.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.06 0.457 . . . . 2.9900000000000002 110.063 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.4 mm -126.03 133.55 68.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.979 -0.555 . . . . 1.8100000000000001 110.473 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.644 ' HB3' HG13 ' B' ' 4' ' ' VAL . 0.2 OUTLIER -91.99 150.2 21.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.061 0.458 . . . . 2.04 110.219 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.549 ' HE1' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -131.11 108.58 9.85 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.315 -0.402 . . . . 1.53 111.832 -178.873 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.576 ' HG3' HG11 ' B' ' 4' ' ' VAL . 11.8 mtmt -81.58 101.51 10.04 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.749 -0.463 . . . . 2.3999999999999999 109.749 178.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.464 HG11 HD23 ' A' ' 47' ' ' LEU . 17.1 m -115.85 166.94 9.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.175 0.512 . . . . 1.5700000000000001 112.287 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -115.04 136.51 53.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.322 -0.854 . . . . 3.2000000000000002 108.987 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 43.4 ttp -78.3 85.31 4.44 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.754 0.311 . . . . 3.0099999999999998 110.495 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.45 -44.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.605 -0.725 . . . . 2.21 109.853 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 148.17 36.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.683 -0.69 . . . . 1.75 111.266 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -67.17 167.85 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 2.4300000000000002 110.362 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.409 HD13 HD12 ' A' ' 71' ' ' ILE . 78.7 mt -75.29 -3.81 35.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 1.8899999999999999 111.08 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.88 -47.2 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.261 -0.644 . . . . 2.4399999999999999 109.261 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -57.09 -40.1 76.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.272 -0.876 . . . . 2.0800000000000001 110.73 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.464 HD23 HG11 ' A' ' 38' ' ' VAL . 1.4 tm? -57.03 -39.2 74.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.587 -0.733 . . . . 2.54 110.895 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -79.0 -55.33 5.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.8 -0.636 . . . . 2.2599999999999998 112.518 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -44.48 94.91 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.017 0.747 . . . . 1.8799999999999999 113.017 -177.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.606 ' HB3' HD11 ' B' ' 7' ' ' LEU . 63.3 m -62.91 -35.33 79.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.624 0.193 . . . . 1.46 111.229 -179.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -66.9 -45.35 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.577 -0.527 . . . . 1.6899999999999999 109.577 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 59.5 m -62.17 -37.36 84.96 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.823 -0.626 . . . . 1.99 110.342 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -61.32 -44.45 97.18 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.975 -0.557 . . . . 2.1699999999999999 111.13 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.417 ' CZ ' HG12 ' B' ' 5' ' ' ILE . 10.4 ttp180 -76.41 -24.49 54.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.846 0.355 . . . . 2.1699999999999999 110.837 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -75.48 -33.79 60.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.361 -0.382 . . . . 2.4100000000000001 110.266 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.44 32.34 6.7 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.766 -0.652 . . . . 2.7400000000000002 111.851 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.21 152.26 79.83 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 122.928 -0.16 . . . . 2.6600000000000001 110.595 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.47 154.39 74.51 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.646 2.231 . . . . 2.9300000000000002 112.129 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.497 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 11.3 tpt -66.59 145.53 55.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.256 -0.429 . . . . 2.52 110.572 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.3 m120 76.54 10.18 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.523 0.729 . . . . 3.6499999999999999 112.344 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.7 p -90.38 -17.71 26.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.297 -0.631 . . . . 2.8700000000000001 109.297 178.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 92' ' ' GLN . 72.6 mt -124.15 149.13 46.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.362 -0.835 . . . . 2.52 110.092 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.529 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 32.5 ptt-85 -119.2 128.61 54.38 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.042 0.449 . . . . 3.4700000000000002 109.886 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.411 ' HB3' HD11 ' A' ' 88' ' ' ILE . 68.3 m-85 -95.81 132.71 40.77 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.946 -0.57 . . . . 2.3999999999999999 109.841 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.8 mt -112.47 138.59 49.01 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.212 0.529 . . . . 3.2000000000000002 111.307 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -138.41 110.12 7.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 2.9700000000000002 108.51 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 64.52 31.92 12.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.939 -0.573 . . . . 3.6400000000000001 110.873 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.53 -31.53 6.72 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.858 -0.686 . . . . 3.75 113.173 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -87.62 161.41 17.71 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.435 -0.209 . . . . 4.6699999999999999 110.435 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.2 ptm180 -94.04 143.66 26.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.968 0.413 . . . . 3.5499999999999998 110.584 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.409 HD12 HD13 ' A' ' 44' ' ' LEU . 30.4 mm -78.46 121.57 31.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.858 -0.61 . . . . 2.5499999999999998 111.81 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -88.74 157.19 18.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 2.8900000000000001 109.891 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -68.9 -22.28 64.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.385 -0.37 . . . . 2.4399999999999999 111.884 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -95.17 8.68 42.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.682 0.277 . . . . 3.29 111.625 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -90.79 153.42 20.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.777 0.322 . . . . 3.27 110.403 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.6 p -123.18 161.38 45.31 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.236 -0.438 . . . . 2.5299999999999998 111.307 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -68.54 -17.89 43.32 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.685 2.257 . . . . 2.21 111.845 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.1 -42.49 66.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.895 -0.593 . . . . 2.9199999999999999 110.546 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.425 ' HG3' ' HG ' ' A' ' 80' ' ' LEU . 15.1 pt-20 -84.09 176.01 9.1 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.102 -0.499 . . . . 3.1800000000000002 110.243 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.425 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 33.1 mt 73.38 -42.56 0.53 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.502 0.721 . . . . 3.04 111.88 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.41 54.29 0.66 Allowed Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.648 -0.581 . . . . 2.7599999999999998 111.648 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.7 ttm -90.47 115.58 27.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.955 0.407 . . . . 2.4100000000000001 110.15 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 34.5 mt-10 -103.53 -178.74 3.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.065 -0.516 . . . . 3.4399999999999999 111.375 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.523 ' HG3' ' HG2' ' A' ' 85' ' ' GLU . 10.1 tp10 -73.4 142.81 46.96 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.109 -0.7 . . . . 2.3399999999999999 109.109 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.523 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 81.2 mm-40 60.32 41.27 16.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.194 0.521 . . . . 2.5499999999999998 109.923 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.4 t0 -85.55 172.46 10.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 2.2799999999999998 110.973 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.4 t -117.92 138.72 47.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.04 0.447 . . . . 2.1899999999999999 111.668 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.524 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 10.4 tt -142.54 127.92 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.536 -0.756 . . . . 1.8600000000000001 109.035 178.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -97.95 160.0 14.58 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.896 0.379 . . . . 2.8999999999999999 111.452 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 p -138.1 127.57 33.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.935 -0.575 . . . . 2.3599999999999999 109.916 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -132.85 153.21 51.54 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.455 -0.339 . . . . 2.9399999999999999 110.392 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.545 ' HA ' HD23 ' A' ' 62' ' ' LEU . 5.6 tt0 -78.48 134.57 37.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.281 -0.418 . . . . 3.6299999999999999 110.91 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.529 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.9 mm-40 -78.01 143.19 37.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.182 -0.463 . . . . 3.6099999999999999 110.026 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -62.35 -23.75 66.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.95 -0.568 . . . . 4.9199999999999999 111.001 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.4 p -71.84 -30.37 65.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.782 -0.645 . . . . 4.4100000000000001 110.763 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.91 15.07 81.66 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.761 -0.654 . . . . 3.73 112.233 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.88 0 CA-C-O 119.161 -0.799 . . . . 3.6800000000000002 111.346 -179.858 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.644 HG13 ' HB3' ' A' ' 35' ' ' HIS . 1.9 t . . . . . 0 N--CA 1.446 -0.628 0 CA-C-O 120.9 0.381 . . . . 2.1299999999999999 111.163 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' ILE . . . . . 0.528 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 16.2 mt -70.91 128.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.077 -0.712 . . . . 1.6100000000000001 109.077 178.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -80.6 105.85 12.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.832 0.348 . . . . 2.5299999999999998 111.147 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.606 HD11 ' HB3' ' A' ' 50' ' ' SER . 1.3 tp . . . . . 0 C--N 1.316 -0.875 0 N-CA-C 108.452 -0.944 . . . . 1.77 108.452 177.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 110.161 -0.311 . . . . 2.7200000000000002 110.161 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 42.4 mm -90.38 135.0 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 110.205 -0.294 . . . . 1.99 110.205 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HB3' ' OE2' ' A' ' 84' ' ' GLU . 2.0 ttpm? -113.72 120.22 40.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.29 0.567 . . . . 3.0699999999999998 111.538 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.5 mt -104.18 150.24 24.55 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.139 -0.689 . . . . 1.3600000000000001 109.139 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -103.93 121.39 43.03 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.92 -0.312 . . . . 2.7000000000000002 110.878 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 6.6 t -93.08 121.39 43.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.904 -0.589 . . . . 1.6200000000000001 109.988 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.4 mm -103.37 120.57 53.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.907 0.384 . . . . 2.3900000000000001 111.017 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.58 167.87 24.83 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.653 -0.703 . . . . 2.6400000000000001 111.583 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 -77.01 -17.71 58.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.116 0.484 . . . . 3.73 110.639 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -85.88 20.96 2.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.465 . . . . 3.0699999999999998 110.364 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m 58.96 64.3 1.44 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.596 -0.729 . . . . 3.25 110.91 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -135.76 144.58 45.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.491 -0.777 . . . . 2.4700000000000002 110.462 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -126.04 94.3 4.06 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.443 -0.577 . . . . 2.9900000000000002 109.443 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.425 ' HA ' HG11 ' B' ' 2' ' ' VAL . 9.8 mm -90.5 145.4 7.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.056 -0.52 . . . . 1.8100000000000001 110.9 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 32.6 m170 -89.02 132.98 34.5 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.888 -0.782 . . . . 2.04 108.888 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.453 ' CE1' HD12 ' B' ' 7' ' ' LEU . 0.8 OUTLIER -123.16 110.52 15.37 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.817 0.341 . . . . 1.53 110.884 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.574 ' HB2' HG22 ' B' ' 4' ' ' VAL . 24.3 ttmt -81.48 110.65 17.08 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.949 -0.569 . . . . 2.3999999999999999 110.712 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.7 m -114.13 154.69 15.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.088 0.47 . . . . 1.5700000000000001 110.465 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.519 ' HG2' HG22 ' A' ' 41' ' ' THR . 52.6 tttt -106.67 127.27 53.22 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.378 -0.374 . . . . 3.2000000000000002 110.143 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.647 ' O ' ' HB ' ' A' ' 41' ' ' THR . 63.1 tpp -74.3 85.88 1.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 3.0099999999999998 110.565 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.647 ' HB ' ' O ' ' A' ' 40' ' ' MET . 7.4 t 154.31 -20.53 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.274 1.03 . . . . 2.21 109.055 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.6 m -84.33 134.89 34.49 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.867 -0.606 . . . . 1.75 110.573 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.15 132.95 54.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.929 -0.578 . . . . 2.4300000000000002 110.104 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.93 -18.45 60.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.56 0.219 . . . . 1.8899999999999999 110.833 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 34.0 tptt -53.9 -47.41 71.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.265 0.555 . . . . 2.4399999999999999 109.764 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -66.9 -43.35 83.59 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.257 -0.883 . . . . 2.0800000000000001 111.063 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -61.72 -44.76 96.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.836 0.351 . . . . 2.54 111.077 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -61.25 -52.82 63.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.041 -0.527 . . . . 2.2599999999999998 112.354 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.7 pt-20 -63.32 -44.12 95.86 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.422 0.527 . . . . 1.8799999999999999 112.422 -178.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.68 ' HB2' HD13 ' B' ' 7' ' ' LEU . 3.9 m -65.55 -33.44 75.93 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.275 -0.17 . . . . 1.46 111.347 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -69.31 -37.28 77.7 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.574 -0.45 . . . . 1.6899999999999999 110.012 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 66.7 m -60.95 -39.7 90.48 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.256 -0.646 . . . . 1.99 109.256 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 85.1 mt-30 -63.79 -39.65 94.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.283 -0.872 . . . . 2.1699999999999999 110.156 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ttt180 -64.84 -33.62 76.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.055 0.455 . . . . 2.1699999999999999 109.788 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -70.87 -35.59 72.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.862 -0.608 . . . . 2.4100000000000001 110.03 178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.65 20.63 8.81 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 121.01 -0.614 . . . . 2.7400000000000002 112.088 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.7 m -132.62 155.83 80.78 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.438 -0.208 . . . . 2.6600000000000001 110.438 -179.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.51 164.03 36.75 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.239 1.959 . . . . 2.9300000000000002 111.217 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 12.3 ttt -71.27 163.04 28.42 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 121.172 -0.211 . . . . 2.52 110.564 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' MET . 16.2 m120 75.7 -0.85 3.12 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.301 0.64 . . . . 3.6499999999999999 111.843 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.6 p -85.26 -29.96 24.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.19 0.519 . . . . 2.8700000000000001 109.809 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.6 mt -119.59 146.13 45.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.472 -0.786 . . . . 2.52 110.594 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.0 ptt-85 -110.8 134.04 52.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.982 -0.554 . . . . 3.4700000000000002 110.023 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -96.44 120.53 36.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 2.3999999999999999 109.315 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.5 mt -108.19 130.57 55.13 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.284 0.564 . . . . 3.2000000000000002 111.572 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -127.46 108.2 10.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.076 -0.965 . . . . 2.9700000000000002 108.409 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.94 17.46 10.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.014 -0.539 . . . . 3.6400000000000001 111.013 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 105.77 -26.65 20.43 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 121.085 -0.579 . . . . 3.75 112.285 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -87.03 145.9 26.31 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.87 -0.419 . . . . 4.6699999999999999 109.87 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -81.42 133.71 35.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.219 0.533 . . . . 3.5499999999999998 110.383 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.403 HD13 ' HA ' ' A' ' 71' ' ' ILE . 24.0 mm -74.2 113.89 13.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.818 -0.628 . . . . 2.5499999999999998 110.318 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HB3' ' CD2' ' A' ' 75' ' ' HIS . . . -72.38 155.72 39.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.809 -0.632 . . . . 2.8900000000000001 110.497 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -65.23 -34.73 79.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.364 0.602 . . . . 2.4399999999999999 110.434 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -86.99 34.24 0.67 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.523 -0.762 . . . . 3.29 111.977 -179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.427 ' CD2' ' HB3' ' A' ' 72' ' ' ALA . 17.2 m170 -114.91 159.34 20.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.11 0.481 . . . . 3.27 111.086 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.493 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 3.0 p -133.83 157.69 77.21 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.657 -0.702 . . . . 2.5299999999999998 109.761 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -64.28 -14.29 43.04 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.412 2.075 . . . . 2.21 112.762 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -68.37 -36.35 79.06 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.217 -0.447 . . . . 2.9199999999999999 110.673 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 76' ' ' THR . 6.0 pt-20 -94.07 177.65 5.91 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.422 -0.584 . . . . 3.1800000000000002 109.422 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.6 mt 73.62 -47.29 0.65 Allowed 'General case' 0 N--CA 1.47 0.53 0 O-C-N 123.652 0.595 . . . . 3.04 110.825 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.71 47.06 0.75 Allowed Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.091 -0.576 . . . . 2.7599999999999998 111.858 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.6 mtt -77.85 132.98 38.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.945 0.402 . . . . 2.4100000000000001 110.62 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.49 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 32.3 mt-10 -126.2 177.04 6.64 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.121 -0.491 . . . . 3.4399999999999999 110.788 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.416 ' OE2' ' HB3' ' A' ' 23' ' ' LYS . 15.7 tp10 -71.87 143.13 49.51 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.088 -0.708 . . . . 2.3399999999999999 109.088 178.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 66.64 28.42 9.19 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.504 0.503 . . . . 2.5499999999999998 110.577 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.2 t0 -74.59 168.92 18.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.032 -0.531 . . . . 2.2799999999999998 110.403 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.5 t -120.19 124.62 73.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.754 0.311 . . . . 2.1899999999999999 111.245 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 19.5 tt -125.31 133.05 70.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.572 -0.529 . . . . 1.8600000000000001 109.572 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.11 150.57 23.12 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.914 0.388 . . . . 2.8999999999999999 111.217 -178.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.7 p -133.96 128.12 52.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.002 -0.545 . . . . 2.3599999999999999 110.521 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -132.96 162.25 32.16 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.262 -0.426 . . . . 2.9399999999999999 110.09 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -89.97 134.88 33.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.021 0.439 . . . . 3.6299999999999999 110.981 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -72.39 150.26 43.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.94 -0.573 . . . . 3.6099999999999999 109.624 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -63.14 -35.97 82.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.388 -0.369 . . . . 4.9199999999999999 111.509 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 p -68.13 -31.63 71.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.859 0.361 . . . . 4.4100000000000001 111.212 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.57 -10.05 68.92 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 121.017 -0.611 . . . . 3.73 111.941 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.707 -1.052 . . . . 3.6800000000000002 111.974 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 56.1 mmtt . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.01 -0.367 . . . . 7.46 110.01 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.425 HG11 ' HA ' ' A' ' 34' ' ' ILE . 2.1 t -77.39 148.6 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.493 -0.558 . . . . 2.6499999999999999 109.493 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -68.41 138.19 55.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.812 0.339 . . . . 2.5 110.654 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.574 HG22 ' HB2' ' A' ' 37' ' ' LYS . 12.1 p -97.3 124.35 50.14 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 N-CA-C 108.603 -0.888 . . . . 2.1299999999999999 108.603 179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.472 HG22 ' HG ' ' B' ' 7' ' ' LEU . 3.9 mt -68.86 104.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.701 -0.682 . . . . 1.6100000000000001 110.33 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -83.16 104.6 13.47 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.836 -0.62 . . . . 2.5299999999999998 110.486 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.68 HD13 ' HB2' ' A' ' 50' ' ' SER . 96.7 mt -135.09 12.7 3.59 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.238 0.542 . . . . 1.77 109.678 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 17.4 p -72.65 133.35 44.6 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.632 -0.713 . . . . 3.0 110.77 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 38.8 mt -67.55 94.04 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.294 0.568 . . . . 3.7400000000000002 110.371 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -156.24 -63.5 0.11 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.941 -1.027 . . . . 6.2199999999999998 108.449 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 1.4 m -100.55 141.47 33.36 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.369 -0.832 . . . . 5.71 109.132 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 10.1 m -74.19 87.27 1.93 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.965 0.412 . . . . 6.2300000000000004 110.582 -179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.2 m -130.72 17.68 5.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.317 0.488 . . . . 5.9000000000000004 112.317 -178.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 19.7 t0 . . . . . 0 C--N 1.327 -0.404 0 C-N-CA 120.747 -0.381 . . . . 5.6200000000000001 110.304 179.296 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.716 ' CD2' HG21 ' B' ' 8' ' ' THR . 20.1 m-85 . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 109.51 -0.552 . . . . 2.7200000000000002 109.51 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.9 mm -73.35 119.4 20.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.787 0.327 . . . . 1.99 110.736 -179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.645 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -97.69 123.37 41.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 3.0699999999999998 110.678 179.201 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 36' ' ' PHE . 70.8 mt -110.58 118.2 35.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.871 -0.604 . . . . 1.3600000000000001 109.517 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -80.83 109.32 15.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.905 0.383 . . . . 2.7000000000000002 110.631 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.1 t -81.02 115.46 23.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.734 -0.666 . . . . 1.6200000000000001 109.999 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.5 mm -107.3 126.97 63.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.031 -0.531 . . . . 2.3900000000000001 110.707 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.57 172.32 21.9 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.797 -0.716 . . . . 2.6400000000000001 111.855 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -64.72 -23.07 67.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.163 0.506 . . . . 3.73 111.113 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -86.71 15.87 5.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.214 -0.448 . . . . 3.0699999999999998 110.634 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.5 m 61.92 37.01 15.48 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.958 -0.565 . . . . 3.25 111.036 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.6 p -86.39 152.14 22.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.856 -0.611 . . . . 2.4700000000000002 110.798 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -125.99 115.64 20.21 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.266 -0.424 . . . . 2.9900000000000002 110.323 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.422 ' HB ' ' HB ' ' A' ' 26' ' ' VAL . 70.4 mt -125.97 139.38 51.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.51 -0.552 . . . . 1.8100000000000001 109.51 179.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.843 ' HB3' HG13 ' B' ' 4' ' ' VAL . 10.5 m170 -88.54 158.44 18.3 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.184 0.516 . . . . 2.04 111.176 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.645 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -141.05 120.12 12.83 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.279 -0.419 . . . . 1.53 110.765 -179.365 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.505 ' N ' HG12 ' B' ' 4' ' ' VAL . 5.2 mtmt -100.02 96.87 7.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.664 0.268 . . . . 2.3999999999999999 110.376 179.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.4 m -113.8 162.66 11.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.896 0.379 . . . . 1.5700000000000001 110.945 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 67.5 tttt -128.28 141.43 51.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.189 -0.46 . . . . 3.2000000000000002 109.899 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 30.6 ttm -78.09 84.99 4.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.303 0.573 . . . . 3.0099999999999998 110.331 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 16.2 m -163.74 -46.32 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.327 -0.852 . . . . 2.21 109.115 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.69 149.07 22.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.296 -0.865 . . . . 1.75 111.507 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -63.93 152.59 39.5 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.27 -0.423 . . . . 2.4300000000000002 110.42 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.7 mt -67.82 -11.86 59.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.766 0.317 . . . . 1.8899999999999999 111.177 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -65.85 -30.71 71.37 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.343 -0.614 . . . . 2.4399999999999999 109.343 178.64 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.436 ' N ' ' HG3' ' A' ' 45' ' ' LYS . 42.4 tptt -68.88 -32.73 72.6 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.5 -0.773 . . . . 2.0800000000000001 109.074 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.493 ' HA ' ' CD1' ' B' ' 7' ' ' LEU . 0.5 OUTLIER -68.81 -41.69 78.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.195 -0.911 . . . . 2.54 110.043 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -64.5 -51.78 61.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.464 -0.789 . . . . 2.2599999999999998 111.834 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.6 pt-20 -66.29 -43.64 85.75 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.302 0.482 . . . . 1.8799999999999999 112.302 -178.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.44 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 50.3 m -61.46 -36.58 80.81 Favored 'General case' 0 C--N 1.329 -0.317 0 O-C-N 122.4 -0.187 . . . . 1.46 111.384 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -68.88 -38.54 79.76 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.822 -0.436 . . . . 1.6899999999999999 109.822 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 75.4 m -63.13 -42.27 99.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 1.99 109.698 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.44 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 78.7 mt-30 -64.99 -35.62 81.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.853 -0.612 . . . . 2.1699999999999999 110.2 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -68.08 -42.45 80.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.744 -0.662 . . . . 2.1699999999999999 110.778 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -79.23 -11.81 59.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.058 -0.519 . . . . 2.4100000000000001 111.332 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.5 31.67 44.93 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.014 -0.612 . . . . 2.7400000000000002 112.632 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.9 m -121.78 156.53 58.93 Favored Pre-proline 0 C--N 1.325 -0.463 0 O-C-N 122.892 -0.181 . . . . 2.6600000000000001 110.731 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -69.54 159.99 51.45 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.642 2.228 . . . . 2.9300000000000002 112.103 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.8 145.58 53.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.234 -0.439 . . . . 2.52 111.16 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 71.64 16.81 5.7 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.702 0.801 . . . . 3.6499999999999999 112.541 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.2 p -92.42 -27.6 17.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.461 0.648 . . . . 2.8700000000000001 109.611 178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.3 mt -111.66 141.75 44.86 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.21 -0.904 . . . . 2.52 110.245 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.467 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 11.4 ptt180 -107.92 118.95 38.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.546 -0.539 . . . . 3.4700000000000002 109.546 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -91.04 124.81 35.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.619 -0.719 . . . . 2.3999999999999999 109.748 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.7 mt -114.34 136.7 52.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.335 0.588 . . . . 3.2000000000000002 112.052 -178.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.408 ' HB2' HD11 ' A' ' 71' ' ' ILE . 78.7 t80 -129.94 107.47 9.39 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.741 -1.118 . . . . 2.9700000000000002 108.521 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 61.27 35.23 18.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.979 -0.555 . . . . 3.6400000000000001 110.982 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.3 -5.42 84.42 Favored Glycine 0 CA--C 1.52 0.354 0 CA-C-N 115.865 -0.607 . . . . 3.75 113.202 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -104.48 148.0 26.95 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 110.152 -0.314 . . . . 4.6699999999999999 110.152 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 70' ' ' ARG . 12.4 ptm180 -85.94 139.47 31.18 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.43 -0.508 . . . . 3.5499999999999998 110.476 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 66' ' ' PHE . 37.4 mm -75.27 113.82 14.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.839 -0.619 . . . . 2.5499999999999998 111.403 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.13 161.42 22.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.161 -0.472 . . . . 2.8900000000000001 110.047 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.5 -23.82 58.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.252 -0.431 . . . . 2.4399999999999999 110.971 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -90.56 3.17 54.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.307 -0.406 . . . . 3.29 110.82 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -85.14 147.08 26.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.342 -0.39 . . . . 3.27 110.512 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 40.1 p -126.11 160.93 54.69 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.077 -0.511 . . . . 2.5299999999999998 110.14 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.37 -7.92 21.54 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.503 2.135 . . . . 2.21 112.023 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -76.23 -31.34 58.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.829 -0.623 . . . . 2.9199999999999999 110.365 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 76' ' ' THR . 7.4 pt-20 -102.33 -171.01 1.89 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 3.1800000000000002 110.355 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 62.2 mt 72.72 -36.24 0.35 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.523 0.729 . . . . 3.04 111.924 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 104.65 35.02 3.38 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.944 -0.646 . . . . 2.7599999999999998 111.856 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.1 mtt -70.12 129.1 38.5 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.913 0.387 . . . . 2.4100000000000001 111.091 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -126.76 176.27 7.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.054 -0.521 . . . . 3.4399999999999999 110.17 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -64.23 142.71 58.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.182 -0.463 . . . . 2.3399999999999999 110.398 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 54.66 50.68 15.36 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.672 0.608 . . . . 2.5499999999999998 111.221 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.68 -175.61 4.71 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.418 -0.356 . . . . 2.2799999999999998 110.366 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.95 138.67 53.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 2.1899999999999999 111.407 -178.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.471 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 14.9 tt -137.11 132.27 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.146 -0.687 . . . . 1.8600000000000001 109.146 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -104.36 146.21 29.15 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.596 0.236 . . . . 2.8999999999999999 110.663 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 8.7 p -131.47 129.95 62.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.046 0.45 . . . . 2.3599999999999999 110.431 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -134.68 162.79 31.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.035 -0.53 . . . . 2.9399999999999999 110.135 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -83.9 135.6 34.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.602 -0.272 . . . . 3.6299999999999999 110.852 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.467 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 7.1 mm-40 -77.19 146.91 36.75 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.113 -0.328 . . . . 3.6099999999999999 110.113 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -68.13 -26.0 65.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.868 0.366 . . . . 4.9199999999999999 110.792 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -35.19 79.7 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.15 -0.477 . . . . 4.4100000000000001 111.125 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.11 -37.65 3.37 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.886 -0.673 . . . . 3.73 112.203 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.909 0 CA-C-O 118.7 -1.056 . . . . 3.6800000000000002 111.762 179.904 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 72.1 mttt . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 110.102 -0.333 . . . . 7.46 110.102 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.9 t -117.4 105.89 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 N-CA-C 109.507 -0.553 . . . . 2.6499999999999999 109.507 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -119.15 143.42 47.22 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.179 -0.674 . . . . 2.5 109.179 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.843 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.2 OUTLIER -94.99 106.6 18.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.664 0.268 . . . . 2.1299999999999999 110.853 -178.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.419 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 13.7 mt -69.72 115.98 9.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.479 -0.563 . . . . 1.6100000000000001 109.479 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . 0.462 ' O ' HD23 ' B' ' 7' ' ' LEU . 20.4 m-20 -72.27 106.13 4.32 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 116.665 -0.243 . . . . 2.5299999999999998 110.948 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.493 ' CD1' ' HA ' ' A' ' 47' ' ' LEU . 11.2 mt -120.13 7.1 10.77 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.682 -0.488 . . . . 1.77 109.682 178.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . 0.716 HG21 ' CD2' ' A' ' 21' ' ' TYR . 56.9 p -64.94 102.41 0.6 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.804 -0.634 . . . . 3.0 111.041 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 27.5 mt -129.54 126.51 63.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.794 -0.447 . . . . 3.7400000000000002 109.794 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -91.35 -39.33 12.09 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.853 -0.339 . . . . 6.2199999999999998 110.955 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.29 -57.3 0.49 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.613 -0.267 . . . . 5.71 111.464 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 3.9 p -166.75 -86.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.977 0.418 . . . . 6.2300000000000004 111.446 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.3 m -94.48 50.59 1.36 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.974 -0.557 . . . . 5.9000000000000004 111.274 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 116.279 -0.419 . . . . 5.6200000000000001 109.989 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.456 ' CZ ' ' HB ' ' B' ' 8' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 110.033 -0.358 . . . . 2.7200000000000002 110.033 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 84' ' ' GLU . 32.3 mm -73.26 122.1 25.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.869 -0.419 . . . . 1.99 109.869 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.565 ' HE3' ' CD2' ' A' ' 35' ' ' HIS . 9.6 ttpt -98.62 119.34 37.18 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.352 -0.385 . . . . 3.0699999999999998 110.462 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 85.5 mt -101.58 142.18 33.34 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.929 -0.578 . . . . 1.3600000000000001 110.012 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -97.69 103.08 14.99 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.798 -0.445 . . . . 2.7000000000000002 109.798 178.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 2.9 t -82.37 116.08 25.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.108 -0.497 . . . . 1.6200000000000001 110.045 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.526 ' HA ' ' O ' ' A' ' 32' ' ' SER . 38.1 mm -108.16 123.25 63.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.928 -0.578 . . . . 2.3900000000000001 111.159 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -97.72 177.93 32.09 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.73 -0.748 . . . . 2.6400000000000001 111.591 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -69.0 -20.47 64.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.237 0.542 . . . . 3.73 110.471 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -86.18 11.7 11.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.58 -0.736 . . . . 3.0699999999999998 110.343 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.1 m 62.0 34.11 16.87 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.394 -0.821 . . . . 3.25 111.968 179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 29.1 p -92.57 150.19 20.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.318 -0.623 . . . . 2.4700000000000002 109.318 178.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.442 ' O ' HG11 ' B' ' 2' ' ' VAL . 2.0 mt-10 -124.36 112.77 17.35 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.977 -0.379 . . . . 2.9900000000000002 109.977 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.665 ' HA ' HG11 ' B' ' 2' ' ' VAL . 15.8 mm -111.96 142.78 23.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.791 -0.448 . . . . 1.8100000000000001 109.791 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.565 ' CD2' ' HE3' ' A' ' 23' ' ' LYS . 47.5 m170 -91.35 140.26 29.94 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.923 0.392 . . . . 2.04 110.17 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.589 ' HE1' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -131.67 121.69 24.7 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.332 0.493 . . . . 1.53 112.332 -178.385 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.49 ' HE3' ' HB ' ' B' ' 4' ' ' VAL . 32.0 mttt -81.39 99.46 8.71 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.557 -0.292 . . . . 2.3999999999999999 110.474 177.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.7 p -115.53 163.7 12.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.983 0.42 . . . . 1.5700000000000001 111.06 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.32 144.06 46.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.419 -0.355 . . . . 3.2000000000000002 110.154 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.6 84.67 7.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.223 0.535 . . . . 3.0099999999999998 109.744 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -166.8 -60.31 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.653 -0.869 . . . . 2.21 108.653 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.7 m -76.45 148.46 37.24 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.919 -1.037 . . . . 1.75 110.304 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.437 ' HA ' HG22 ' A' ' 76' ' ' THR . 12.8 m-70 -62.12 156.73 20.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.001 0.429 . . . . 2.4300000000000002 111.145 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.09 -5.41 35.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.038 -0.528 . . . . 1.8899999999999999 110.588 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -61.9 -42.91 99.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.496 -0.774 . . . . 2.4399999999999999 109.182 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 13.6 tttp -61.94 -39.3 91.63 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 115.584 -0.735 . . . . 2.0800000000000001 109.628 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.441 HD22 ' HA ' ' A' ' 47' ' ' LEU . 0.9 OUTLIER -59.65 -38.39 81.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.293 -0.867 . . . . 2.54 110.184 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -73.05 -52.63 13.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.71 . . . . 2.2599999999999998 112.512 -178.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.488 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 10.0 pt-20 -67.66 -44.31 78.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.936 0.717 . . . . 1.8799999999999999 112.936 -177.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.436 ' HB3' HD11 ' B' ' 7' ' ' LEU . 15.0 m -59.16 -34.94 72.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.794 0.331 . . . . 1.46 111.172 -179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.402 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 27.9 t80 -66.38 -44.1 84.08 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.048 0.451 . . . . 1.6899999999999999 109.818 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 58.0 m -61.66 -33.92 74.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.425 -0.807 . . . . 1.99 110.79 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 97.5 mt-30 -63.31 -40.37 97.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 2.1699999999999999 110.975 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 -74.07 -33.53 63.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 2.1699999999999999 110.619 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 12.4 mm100 -79.79 -8.34 59.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.993 0.425 . . . . 2.4100000000000001 110.77 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 70.79 36.06 66.23 Favored Glycine 0 N--CA 1.451 -0.348 0 CA-C-N 115.998 -0.546 . . . . 2.7400000000000002 113.14 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.408 ' O ' ' HB3' ' A' ' 52' ' ' CYS . 8.0 m -131.88 149.85 74.52 Favored Pre-proline 0 C--N 1.323 -0.58 0 O-C-N 122.621 -0.34 . . . . 2.6600000000000001 110.698 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -65.84 156.57 63.51 Favored 'Trans proline' 0 N--CA 1.464 -0.206 0 C-N-CA 122.493 2.129 . . . . 2.9300000000000002 111.626 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.509 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 20.3 ttt -69.82 152.98 43.94 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 121.109 -0.236 . . . . 2.52 110.426 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.9 m120 78.96 -0.19 2.39 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.618 0.767 . . . . 3.6499999999999999 112.076 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 80.3 p -83.68 -24.67 31.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.65 0.738 . . . . 2.8700000000000001 109.131 178.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -120.61 145.39 47.43 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.911 -1.04 . . . . 2.52 109.836 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HD2' HD11 ' A' ' 65' ' ' LEU . 22.7 ptt-85 -112.33 138.82 48.5 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.043 -0.526 . . . . 3.4700000000000002 109.787 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.431 ' HB3' HD11 ' A' ' 88' ' ' ILE . 49.2 m-85 -107.0 128.26 54.2 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.482 -0.562 . . . . 2.3999999999999999 109.482 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.411 HD11 ' HD2' ' A' ' 63' ' ' ARG . 6.7 mp -116.14 134.42 54.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.226 0.536 . . . . 3.2000000000000002 112.05 -178.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.403 ' HE1' ' OD1' ' A' ' 86' ' ' ASP . 65.2 t80 -129.63 115.56 17.56 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.354 -0.839 . . . . 2.9700000000000002 109.016 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.39 26.32 15.71 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.818 -0.628 . . . . 3.6400000000000001 111.391 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.64 -20.73 49.21 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.985 -0.626 . . . . 3.75 113.426 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -99.79 138.68 36.53 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.955 0.377 . . . . 4.6699999999999999 110.631 -179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -75.46 135.85 40.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.331 0.586 . . . . 3.5499999999999998 110.469 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 36.9 mm -71.05 126.44 31.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.327 -0.851 . . . . 2.5499999999999998 111.86 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.435 ' HB3' ' CD2' ' A' ' 75' ' ' HIS . . . -91.98 162.59 14.32 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.668 -0.696 . . . . 2.8900000000000001 109.729 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -72.92 -24.96 60.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.85 0.357 . . . . 2.4399999999999999 111.406 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -87.95 3.61 48.0 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.86 0.362 . . . . 3.29 110.755 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.435 ' CD2' ' HB3' ' A' ' 72' ' ' ALA . 13.9 m170 -86.48 152.21 22.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.008 0.432 . . . . 3.27 111.013 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 20.6 p -129.97 161.77 57.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.612 -0.722 . . . . 2.5299999999999998 109.8 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -69.13 -13.22 35.86 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.389 2.059 . . . . 2.21 111.765 178.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -74.0 -34.6 64.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.764 -0.653 . . . . 2.9199999999999999 110.418 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.3 pt-20 -91.84 175.88 6.72 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.43 -0.581 . . . . 3.1800000000000002 109.43 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.422 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 24.1 mt 72.04 -29.96 0.2 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.091 0.556 . . . . 3.04 111.845 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 95.64 36.82 5.21 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.977 -0.63 . . . . 2.7599999999999998 112.181 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 50.2 mtp -73.68 131.24 41.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.765 -0.457 . . . . 2.4100000000000001 109.765 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -125.37 -169.06 1.93 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.741 0.305 . . . . 3.4399999999999999 111.32 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 22' ' ' ILE . 9.9 tp10 -71.06 142.83 50.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.986 -0.552 . . . . 2.3399999999999999 110.606 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 72.0 mm-40 59.8 32.25 21.23 Favored 'General case' 0 C--O 1.234 0.255 0 O-C-N 123.548 0.53 . . . . 2.5499999999999998 111.223 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.403 ' OD1' ' HE1' ' A' ' 66' ' ' PHE . 1.1 t0 -76.53 171.01 15.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.916 0.389 . . . . 2.2799999999999998 110.628 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 25.6 t -118.08 140.34 41.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.084 0.469 . . . . 2.1899999999999999 111.707 -178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 18.1 tt -139.0 127.64 28.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.149 -0.686 . . . . 1.8600000000000001 109.149 179.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.418 ' O ' ' HA ' ' A' ' 64' ' ' PHE . 44.5 mt-10 -94.8 149.29 21.4 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.651 0.263 . . . . 2.8999999999999999 111.564 -178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.3 p -130.5 125.66 59.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.131 -0.486 . . . . 2.3599999999999999 110.241 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -132.56 161.54 33.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.308 -0.405 . . . . 2.9399999999999999 110.515 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -86.92 130.93 34.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.806 0.336 . . . . 3.6299999999999999 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -75.73 140.16 42.28 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.488 -0.324 . . . . 3.6099999999999999 110.17 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -56.56 -36.28 69.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.945 -0.57 . . . . 4.9199999999999999 111.156 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.34 -29.54 70.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.114 -0.494 . . . . 4.4100000000000001 111.847 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.09 -1.04 86.43 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 121.06 -0.591 . . . . 3.73 112.586 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.692 -1.06 . . . . 3.6800000000000002 111.833 179.89 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 46.3 mttm . . . . . 0 N--CA 1.48 1.029 0 CA-C-O 120.752 0.311 . . . . 7.46 110.376 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.665 HG11 ' HA ' ' A' ' 34' ' ' ILE . 3.3 t -117.87 148.11 20.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 109.722 -0.473 . . . . 2.6499999999999999 109.722 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -69.42 144.5 53.31 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.984 -0.376 . . . . 2.5 109.984 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 35' ' ' HIS . 1.6 t -107.61 118.51 55.47 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 N-CA-C 109.759 -0.459 . . . . 2.1299999999999999 109.759 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.536 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 21.4 mt -68.64 118.47 12.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.725 -0.472 . . . . 1.6100000000000001 109.725 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -76.51 121.34 22.99 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.871 -0.604 . . . . 2.5299999999999998 111.31 -179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.589 HD13 ' HE1' ' A' ' 36' ' ' PHE . 2.2 mp -125.27 22.47 7.81 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.506 0.67 . . . . 1.77 109.4 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . 0.456 ' HB ' ' CZ ' ' A' ' 21' ' ' TYR . 4.3 t -87.2 -31.14 20.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.172 -0.922 . . . . 3.0 111.735 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 23.3 mm -79.59 79.21 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.384 0.611 . . . . 3.7400000000000002 110.094 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -92.04 -29.58 16.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.471 -0.786 . . . . 6.2199999999999998 109.658 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 6.5 m -112.71 91.44 3.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.63 -0.713 . . . . 5.71 109.52 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 65.7 m -56.48 112.39 1.25 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.998 -0.546 . . . . 6.2300000000000004 110.961 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 4.2 m -107.93 -16.94 14.18 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.623 -0.717 . . . . 5.9000000000000004 110.407 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 36.9 t0 . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 108.902 -0.777 . . . . 5.6200000000000001 108.902 179.716 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' CE2' ' HB ' ' B' ' 8' ' ' THR . 92.3 m-85 . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 109.663 -0.495 . . . . 2.7200000000000002 109.663 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.9 mm -92.98 131.61 39.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.059 0.457 . . . . 1.99 111.574 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HZ3' ' HB3' ' A' ' 23' ' ' LYS . 4.3 ttpm? -110.45 118.79 37.2 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.083 -0.508 . . . . 3.0699999999999998 109.726 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 76.2 mt -101.52 150.41 23.09 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.92 -0.582 . . . . 1.3600000000000001 110.641 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.546 ' HE3' ' NE2' ' A' ' 35' ' ' HIS . 31.9 mtpt -103.42 110.48 22.51 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.411 -0.589 . . . . 2.7000000000000002 109.411 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.1 t -88.46 125.13 41.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.262 -0.426 . . . . 1.6200000000000001 110.517 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 32' ' ' SER . 35.2 mm -113.31 123.88 69.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.935 -0.575 . . . . 2.3900000000000001 110.625 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.38 177.53 40.95 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.937 -0.649 . . . . 2.6400000000000001 111.874 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -69.5 -27.76 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.571 0.185 . . . . 3.73 111.31 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -88.7 26.5 1.49 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.752 0.31 . . . . 3.0699999999999998 110.954 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.5 m 61.64 34.77 17.45 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.316 0.579 . . . . 3.25 110.793 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.544 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -84.45 149.02 26.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.764 -0.653 . . . . 2.4700000000000002 110.343 -179.714 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -131.43 120.04 22.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.183 -0.462 . . . . 2.9900000000000002 110.192 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.8 mm -131.55 139.47 50.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 109.359 -0.608 . . . . 1.8100000000000001 109.359 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.565 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 20.2 m170 -89.49 140.22 29.75 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.473 -0.566 . . . . 2.04 109.473 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.56 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.3 OUTLIER -127.93 106.55 9.17 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.537 -0.301 . . . . 1.53 111.091 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.441 ' HB2' HG22 ' B' ' 4' ' ' VAL . 5.5 ttmt -79.26 103.49 9.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.116 -0.493 . . . . 2.3999999999999999 109.714 178.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 m -109.38 159.65 8.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.043 0.449 . . . . 1.5700000000000001 111.215 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -104.58 126.28 51.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.058 -0.519 . . . . 3.2000000000000002 109.94 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 57.2 ttp -76.57 84.71 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.102 -0.703 . . . . 3.0099999999999998 109.102 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.3 m 168.52 -36.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.772 1.229 . . . . 2.21 108.132 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.5 m -76.26 145.56 39.59 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.168 -0.924 . . . . 1.75 110.603 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -69.76 148.52 49.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.398 -0.365 . . . . 2.4300000000000002 110.723 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.654 ' HA ' HD23 ' A' ' 47' ' ' LEU . 97.1 mt -66.36 -15.07 62.99 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 1.8899999999999999 111.329 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 8.6 tptt -60.03 -39.55 86.26 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.528 -0.545 . . . . 2.4399999999999999 109.528 178.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -61.45 -42.62 99.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.195 -0.911 . . . . 2.0800000000000001 110.683 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.654 HD23 ' HA ' ' A' ' 44' ' ' LEU . 1.8 mm? -66.49 -40.9 89.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.947 -0.569 . . . . 2.54 110.49 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -64.15 -51.07 65.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 2.2599999999999998 112.251 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -63.08 -47.69 81.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.269 0.47 . . . . 1.8799999999999999 112.269 -178.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.584 ' CB ' HD21 ' B' ' 7' ' ' LEU . 67.9 m -65.13 -32.48 74.2 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.818 0.303 . . . . 1.46 111.818 -179.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -66.06 -40.21 90.71 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.018 -0.734 . . . . 1.6899999999999999 109.018 179.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 74.4 m -64.39 -38.05 89.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.647 -0.706 . . . . 1.99 109.493 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.523 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 91.1 mt-30 -64.12 -41.39 97.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.772 -0.649 . . . . 2.1699999999999999 110.281 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.44 ' NH1' HG12 ' B' ' 5' ' ' ILE . 26.9 ttt180 -67.65 -38.76 84.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.463 -0.335 . . . . 2.1699999999999999 111.012 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -79.58 -9.92 59.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.53 -0.305 . . . . 2.4100000000000001 111.293 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 73.09 36.97 56.23 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 121.111 -0.566 . . . . 2.7400000000000002 112.496 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.7 m -125.74 151.55 71.03 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 110.482 -0.192 . . . . 2.6600000000000001 110.482 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -67.07 157.91 59.44 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.844 2.363 . . . . 2.9300000000000002 111.729 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.471 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 16.3 tpt -64.13 143.31 57.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.543 -0.299 . . . . 2.52 111.055 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 59' ' ' MET . 5.0 m120 75.48 1.4 3.62 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.057 0.762 . . . . 3.6499999999999999 113.057 178.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.4 p -74.71 -26.48 59.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.238 0.542 . . . . 2.8700000000000001 109.683 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 44.6 mt -119.11 150.11 40.56 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.386 -0.825 . . . . 2.52 110.148 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.0 ptt-85 -113.06 142.13 46.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.005 -0.543 . . . . 3.4700000000000002 109.658 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.402 ' HB3' HD11 ' A' ' 88' ' ' ILE . 80.6 m-85 -108.48 114.4 28.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.214 -0.448 . . . . 2.3999999999999999 109.805 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 93.6 mt -106.39 123.58 48.29 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.116 0.484 . . . . 3.2000000000000002 111.406 -178.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -124.5 111.43 15.69 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.679 -0.691 . . . . 2.9700000000000002 109.281 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 61.86 24.56 14.64 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.094 -0.503 . . . . 3.6400000000000001 111.347 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.68 73.56 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.551 -0.833 . . . . 3.75 112.401 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -105.41 134.13 49.03 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.786 -0.449 . . . . 4.6699999999999999 109.786 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -78.09 131.2 37.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.325 0.584 . . . . 3.5499999999999998 110.025 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 32.2 mm -68.24 111.47 2.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.536 -0.756 . . . . 2.5499999999999998 111.356 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.51 157.11 24.95 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.144 -0.48 . . . . 2.8900000000000001 110.348 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.415 ' CG ' ' HD3' ' A' ' 45' ' ' LYS . 85.3 m-20 -67.24 -26.34 66.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.114 -0.494 . . . . 2.4399999999999999 111.491 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -93.73 11.81 27.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.348 -0.387 . . . . 3.29 111.46 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.432 ' HB3' HD12 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -91.49 157.02 17.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.123 0.487 . . . . 3.27 110.832 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.576 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -137.48 157.76 73.32 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 2.5299999999999998 110.256 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.91 -19.35 61.99 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.696 2.264 . . . . 2.21 112.636 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -64.63 -35.94 82.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.905 0.383 . . . . 2.9199999999999999 110.888 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 76' ' ' THR . 8.5 pt-20 -94.99 176.88 6.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 3.1800000000000002 110.295 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 81.3 mt 70.13 -9.37 0.74 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.071 0.548 . . . . 3.04 111.906 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 71.1 44.42 54.25 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.923 -0.656 . . . . 2.7599999999999998 111.99 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 34.9 mtt -70.56 138.62 51.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.505 0.193 . . . . 2.4100000000000001 110.628 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.527 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 42.0 mt-10 -127.42 170.12 12.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.797 0.332 . . . . 3.4399999999999999 110.619 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 20.8 tp10 -69.47 140.9 54.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.912 -0.586 . . . . 2.3399999999999999 109.473 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 31.5 mm-40 70.11 19.87 6.59 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.526 0.516 . . . . 2.5499999999999998 111.261 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.7 OUTLIER -73.82 160.94 30.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.975 -0.38 . . . . 2.2799999999999998 109.975 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 82.5 t -108.44 131.35 59.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.045 0.45 . . . . 2.1899999999999999 111.99 -178.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' A' ' 64' ' ' PHE . 17.2 tt -126.0 131.69 71.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.669 -0.863 . . . . 1.8600000000000001 108.669 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -102.88 137.54 40.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.813 0.339 . . . . 2.8999999999999999 111.7 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 5.4 p -121.2 126.61 75.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.07 -0.514 . . . . 2.3599999999999999 110.295 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -132.64 160.87 35.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.638 0.256 . . . . 2.9399999999999999 111.081 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -81.07 135.53 35.83 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.264 -0.425 . . . . 3.6299999999999999 110.948 -179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -84.08 148.11 27.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.229 -0.441 . . . . 3.6099999999999999 109.952 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -66.94 -25.92 66.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.423 -0.353 . . . . 4.9199999999999999 111.655 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.27 -33.19 65.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.713 0.292 . . . . 4.4100000000000001 111.455 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.79 5.73 87.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.766 -0.73 . . . . 3.73 112.024 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.868 0 CA-C-O 118.875 -0.958 . . . . 3.6800000000000002 111.91 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 120.587 0.232 . . . . 7.46 110.602 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.9 m -76.4 150.01 6.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.11 -0.495 . . . . 2.6499999999999999 110.147 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -66.9 138.95 57.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.075 -0.511 . . . . 2.5 111.167 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 10.4 p -105.57 124.95 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-O 121.279 0.561 . . . . 2.1299999999999999 110.382 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.56 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 5.7 mt -76.38 119.36 24.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 109.426 -0.583 . . . . 1.6100000000000001 109.426 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -83.54 105.93 14.86 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 120.676 0.274 . . . . 2.5299999999999998 110.617 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.584 HD21 ' CB ' ' A' ' 50' ' ' SER . 0.4 OUTLIER -134.17 23.38 3.82 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.138 0.494 . . . . 1.77 110.657 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . 0.606 ' HB ' ' CE2' ' A' ' 21' ' ' TYR . 73.1 p -77.18 55.25 1.16 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.846 -0.616 . . . . 3.0 111.096 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . 0.488 HD12 ' O ' ' B' ' 11' ' ' SER . 2.7 pt -129.91 -173.06 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.022 -0.535 . . . . 3.7400000000000002 110.926 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -100.01 -53.46 3.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.055 -0.52 . . . . 6.2199999999999998 110.816 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . 0.488 ' O ' HD12 ' B' ' 9' ' ' ILE . 1.9 p -117.02 162.74 17.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.526 -0.761 . . . . 5.71 110.787 -179.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 18.5 m -62.8 -49.62 74.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.232 0.539 . . . . 6.2300000000000004 109.84 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.61 58.55 4.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.465 -0.789 . . . . 5.9000000000000004 109.675 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.742 -0.663 . . . . 5.6200000000000001 111.279 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 N--CA 1.481 1.111 0 N-CA-C 109.949 -0.389 . . . . 2.7200000000000002 109.949 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.1 mm -84.53 118.58 31.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 109.428 -0.582 . . . . 1.99 109.428 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -93.47 118.66 31.6 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.063 0.459 . . . . 3.0699999999999998 110.938 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 94.0 mt -104.49 150.61 24.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.717 -0.674 . . . . 1.3600000000000001 109.691 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -113.65 113.22 24.73 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.031 0.443 . . . . 2.7000000000000002 111.592 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.439 HG22 ' CG2' ' A' ' 88' ' ' ILE . 60.4 t -96.44 119.37 44.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 109.22 -0.659 . . . . 1.6200000000000001 109.22 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.524 ' HA ' ' O ' ' A' ' 32' ' ' SER . 25.1 mm -100.62 120.39 50.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.789 0.328 . . . . 2.3900000000000001 111.555 -178.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.61 171.0 42.92 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.263 -0.735 . . . . 2.6400000000000001 111.263 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.5 tp60 -69.58 -22.82 63.49 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.126 0.489 . . . . 3.73 110.867 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -85.85 15.26 5.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.977 -0.556 . . . . 3.0699999999999998 110.995 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.0 m 65.51 47.31 2.28 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.231 0.539 . . . . 3.25 111.43 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.524 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 13.3 p -111.6 136.06 51.33 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.351 -0.611 . . . . 2.4700000000000002 109.351 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -115.6 94.96 4.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.992 0.425 . . . . 2.9900000000000002 110.559 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.5 mt -91.07 138.56 19.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.166 -0.47 . . . . 1.8100000000000001 110.235 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.649 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 33.4 m80 -92.12 138.74 31.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.88 -0.6 . . . . 2.04 111.775 -178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.421 ' HZ ' ' CD1' ' A' ' 51' ' ' TYR . 4.4 m-85 -126.17 106.69 9.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.795 -0.639 . . . . 1.53 109.995 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.597 ' HE2' HG21 ' B' ' 4' ' ' VAL . 23.9 mtmt -85.29 96.84 9.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.217 0.532 . . . . 2.3999999999999999 110.89 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.8 m -106.58 171.2 2.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.761 -0.654 . . . . 1.5700000000000001 110.785 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -128.06 141.17 51.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.32 -0.622 . . . . 3.2000000000000002 109.32 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 24.7 ttp -77.64 84.9 3.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.387 0.613 . . . . 3.0099999999999998 109.789 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 48.3 m -164.88 -51.59 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.92 -1.036 . . . . 2.21 108.249 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.34 148.61 32.01 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.825 -1.079 . . . . 1.75 110.313 179.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -67.4 159.16 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.258 -0.428 . . . . 2.4300000000000002 110.616 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 58.9 mt -69.29 -11.88 61.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.249 0.547 . . . . 1.8899999999999999 109.71 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -35.46 72.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.198 -0.91 . . . . 2.4399999999999999 109.216 177.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.5 tptt -60.31 -43.42 96.34 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 115.102 -0.954 . . . . 2.0800000000000001 110.928 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.471 ' HA ' HD13 ' B' ' 7' ' ' LEU . 3.8 tt -64.8 -33.48 76.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.063 0.458 . . . . 2.54 111.044 -179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -74.45 -36.7 63.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 2.2599999999999998 112.002 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 0.1 OUTLIER -82.24 -45.82 14.53 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.61 0.596 . . . . 1.8799999999999999 112.61 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 p -58.8 -45.53 89.66 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.328 0.492 . . . . 1.46 112.328 -178.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.421 ' CD1' ' HZ ' ' A' ' 36' ' ' PHE . 6.9 t80 -64.33 -36.2 83.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.72 -0.392 . . . . 1.6899999999999999 111.39 -179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 83.7 m -61.22 -39.42 90.19 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.091 0.472 . . . . 1.99 109.948 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -63.88 -44.28 93.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.562 -0.744 . . . . 2.1699999999999999 110.391 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.429 HH12 ' HB2' ' B' ' 3' ' ' ASP . 16.5 ttt180 -65.72 -42.21 91.34 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.973 -0.558 . . . . 2.1699999999999999 110.837 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -69.2 -26.86 65.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.506 -0.315 . . . . 2.4100000000000001 110.903 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.61 33.18 10.4 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.8 -0.714 . . . . 2.7400000000000002 111.84 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 5.0 m -133.01 154.3 81.3 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.745 0.307 . . . . 2.6600000000000001 110.5 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.69 149.86 73.82 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.56 2.173 . . . . 2.9300000000000002 111.722 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.525 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 23.1 ttt -68.64 161.66 27.65 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.504 -0.317 . . . . 2.52 110.242 179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 59' ' ' MET . 11.3 m120 78.53 -12.09 1.13 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.512 0.725 . . . . 3.6499999999999999 111.589 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.5 p -78.3 -31.24 48.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.341 0.591 . . . . 2.8700000000000001 109.515 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -108.84 131.66 54.77 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.438 -0.801 . . . . 2.52 110.1 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 ptt-85 -107.99 122.92 47.84 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.021 -0.536 . . . . 3.4700000000000002 110.086 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -88.3 125.11 34.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.964 -0.562 . . . . 2.3999999999999999 109.696 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 54.4 mt -110.06 131.64 54.88 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.986 -0.552 . . . . 3.2000000000000002 110.862 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -124.81 106.34 9.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.621 -0.718 . . . . 2.9700000000000002 109.291 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 64.35 33.2 11.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.413 -0.812 . . . . 3.6400000000000001 111.054 -179.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.83 -21.07 45.6 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.815 -0.707 . . . . 3.75 113.895 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -103.2 138.71 39.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.263 0.531 . . . . 4.6699999999999999 110.565 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -70.47 148.42 48.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.297 0.57 . . . . 3.5499999999999998 111.061 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 29.5 mm -85.22 120.88 36.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.427 -0.806 . . . . 2.5499999999999998 111.533 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.87 156.52 24.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.962 -0.563 . . . . 2.8900000000000001 109.913 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -70.08 -27.03 64.29 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.267 -0.424 . . . . 2.4399999999999999 111.598 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -87.63 1.23 54.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.309 -0.405 . . . . 3.29 111.234 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.7 m170 -85.16 144.92 27.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.045 0.45 . . . . 3.27 110.858 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.483 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 41.8 p -120.99 161.63 39.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.709 -0.678 . . . . 2.5299999999999998 109.926 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.81 -3.08 7.5 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.666 2.244 . . . . 2.21 112.479 179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -79.64 -35.5 39.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.955 -0.566 . . . . 2.9199999999999999 110.37 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 76' ' ' THR . 2.9 pt-20 -94.54 -179.57 4.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.185 -0.462 . . . . 3.1800000000000002 109.992 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.6 mt 73.05 -29.54 0.2 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.327 0.651 . . . . 3.04 111.776 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 79' ' ' GLU . . . 94.06 34.58 6.4 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.363 -0.695 . . . . 2.7599999999999998 111.363 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.2 ttm -65.7 128.76 37.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 2.4100000000000001 110.974 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -121.46 -177.65 3.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.987 -0.551 . . . . 3.4399999999999999 110.635 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -75.59 144.52 41.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.149 -0.478 . . . . 2.3399999999999999 110.275 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 62.1 27.05 16.31 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 123.582 0.551 . . . . 2.5499999999999998 110.584 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.68 140.64 40.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.004 -0.544 . . . . 2.2799999999999998 110.602 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.403 HG13 HG12 ' A' ' 27' ' ' ILE . 54.8 t -90.38 127.28 42.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.708 -0.678 . . . . 2.1899999999999999 111.631 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.439 ' CG2' HG22 ' A' ' 26' ' ' VAL . 19.3 tt -125.68 139.97 49.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.61 -0.885 . . . . 1.8600000000000001 108.61 178.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -104.86 157.99 16.83 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.992 0.425 . . . . 2.8999999999999999 111.444 -178.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 p -141.19 121.91 12.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.975 -0.557 . . . . 2.3599999999999999 110.418 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -128.55 161.7 28.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.029 -0.532 . . . . 2.9399999999999999 109.711 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -92.42 138.41 31.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 3.6299999999999999 110.955 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -72.36 142.67 48.76 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.892 -0.595 . . . . 3.6099999999999999 110.019 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -66.98 -34.41 77.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.393 -0.367 . . . . 4.9199999999999999 110.597 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -35.52 80.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.019 -0.537 . . . . 4.4100000000000001 111.408 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.24 -27.68 15.01 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.842 -0.694 . . . . 3.73 111.902 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.874 0 CA-C-O 118.88 -0.955 . . . . 3.6800000000000002 111.749 179.745 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 84.6 mttt . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 110.026 -0.361 . . . . 7.46 110.026 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.0 m -102.3 145.94 11.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.818 0.342 . . . . 2.6499999999999999 110.594 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.429 ' HB2' HH12 ' A' ' 54' ' ' ARG . 13.8 m-20 -77.61 115.34 17.29 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.496 -0.557 . . . . 2.5 109.496 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.649 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 7.4 p -84.85 121.62 37.11 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.89 0 N-CA-C 109.278 -0.638 . . . . 2.1299999999999999 109.278 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -90.58 109.61 21.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.829 -0.623 . . . . 1.6100000000000001 110.757 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . 0.41 ' HA ' ' O ' ' A' ' 37' ' ' LYS . 1.8 m-20 -76.46 117.95 18.64 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 116.058 -0.519 . . . . 2.5299999999999998 109.757 179.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 47' ' ' LEU . 13.1 mt -123.33 36.98 4.52 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.45 0.643 . . . . 1.77 110.033 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 3.4 t -69.21 -19.5 63.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.307 -0.86 . . . . 3.0 111.563 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 2.0 pt -124.88 154.55 32.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.448 -0.342 . . . . 3.7400000000000002 110.96 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.415 ' OE2' ' HD3' ' A' ' 46' ' ' LYS . 11.8 tp10 -76.32 -36.36 58.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.471 0.653 . . . . 6.2199999999999998 109.549 179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 5.6 m -124.38 127.3 47.36 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.778 -0.647 . . . . 5.71 110.086 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 9.7 m -53.94 121.02 7.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.074 0.464 . . . . 6.2300000000000004 110.786 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.6 m -116.13 22.08 13.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.104 0.478 . . . . 5.9000000000000004 110.689 -179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 1.2 t70 . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.856 -0.611 . . . . 5.6200000000000001 109.608 179.861 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.576 ' CE2' ' HB ' ' B' ' 8' ' ' THR . 95.8 m-85 . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 110.001 -0.37 . . . . 2.7200000000000002 110.001 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.3 mm -74.64 129.52 36.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 116.464 -0.334 . . . . 1.99 110.118 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 tttt -103.39 119.76 39.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.164 0.507 . . . . 3.0699999999999998 111.364 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.0 mt -106.33 150.25 26.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.561 -0.745 . . . . 1.3600000000000001 109.537 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -104.74 106.57 17.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.432 -0.349 . . . . 2.7000000000000002 110.581 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.4 t -81.01 123.02 37.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.202 -0.666 . . . . 1.6200000000000001 109.202 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 89' ' ' GLU . 48.1 mm -117.92 108.57 24.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.013 0.435 . . . . 2.3900000000000001 110.625 -179.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.28 170.13 50.42 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.582 -0.818 . . . . 2.6400000000000001 111.29 179.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -64.99 -27.69 69.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.14 0.495 . . . . 3.73 110.731 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -89.15 25.41 1.87 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.686 -0.688 . . . . 3.0699999999999998 111.411 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 63.8 m 60.11 33.84 21.21 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.167 0.508 . . . . 3.25 111.839 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.42 114.11 23.74 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.991 -0.55 . . . . 2.4700000000000002 109.739 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.646 ' O ' HG11 ' B' ' 2' ' ' VAL . 3.7 mt-10 -101.37 108.75 20.45 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.609 -0.515 . . . . 2.9900000000000002 109.609 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.652 ' HA ' HG11 ' B' ' 2' ' ' VAL . 7.8 mm -115.66 144.43 23.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.567 0.223 . . . . 1.8100000000000001 110.41 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -89.06 141.78 28.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.916 0.389 . . . . 2.04 110.391 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.491 ' CD1' ' HB ' ' B' ' 5' ' ' ILE . 0.1 OUTLIER -133.79 104.41 6.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 1.53 111.063 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.404 ' CE ' HG11 ' B' ' 4' ' ' VAL . 4.7 mtmt -91.01 106.75 18.74 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.254 0.55 . . . . 2.3999999999999999 110.982 178.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.45 HG11 HD23 ' A' ' 47' ' ' LEU . 18.0 m -111.83 170.46 3.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.689 -0.687 . . . . 1.5700000000000001 111.249 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.483 ' HE2' ' OG1' ' A' ' 42' ' ' THR . 16.1 pttm -119.16 138.67 52.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.989 -0.55 . . . . 3.2000000000000002 109.922 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 42.7 tpp -75.1 84.71 2.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.125 0.488 . . . . 3.0099999999999998 110.141 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.3 -55.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 2.21 109.369 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.483 ' OG1' ' HE2' ' A' ' 39' ' ' LYS . 0.8 OUTLIER -79.09 147.64 32.7 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.126 -0.943 . . . . 1.75 110.841 -179.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -70.19 173.51 6.58 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.236 -0.653 . . . . 2.4300000000000002 109.236 178.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.01 3.89 6.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.246 0.546 . . . . 1.8899999999999999 110.139 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 73' ' ' ASP . 36.4 tptt -60.24 -46.2 90.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.102 -0.953 . . . . 2.4399999999999999 109.208 177.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -65.24 -38.48 90.48 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.888 -1.051 . . . . 2.0800000000000001 110.037 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.45 HD23 HG11 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -53.93 -46.15 71.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.815 -0.63 . . . . 2.54 110.581 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HA ' ' CE2' ' A' ' 64' ' ' PHE . 53.7 mtpt -70.05 -54.67 12.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.725 -0.67 . . . . 2.2599999999999998 112.647 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.67 -43.62 79.79 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.198 0.814 . . . . 1.8799999999999999 113.198 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.8 m -63.47 -37.1 86.0 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.327 -0.233 . . . . 1.46 111.537 -178.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -67.17 -43.68 81.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.636 -0.426 . . . . 1.6899999999999999 109.915 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.66 -37.65 82.24 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.01 0.433 . . . . 1.99 110.303 179.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -60.39 -43.08 96.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.825 -0.625 . . . . 2.1699999999999999 110.518 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.18 -28.78 61.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.326 -0.397 . . . . 2.1699999999999999 110.888 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -74.92 -19.68 60.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.511 -0.313 . . . . 2.4100000000000001 111.184 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.64 25.38 42.5 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.609 -0.805 . . . . 2.7400000000000002 112.288 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 7.0 m -127.73 154.7 77.91 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 110.07 -0.345 . . . . 2.6600000000000001 110.07 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.38 161.91 44.28 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.283 1.988 . . . . 2.9300000000000002 111.771 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.06 153.36 43.9 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.292 -0.413 . . . . 2.52 110.664 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 t30 74.96 5.97 4.32 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.612 0.765 . . . . 3.6499999999999999 112.069 179.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.5 p -88.81 -26.01 21.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.263 0.554 . . . . 2.8700000000000001 109.698 178.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 43.7 mt -115.5 146.22 41.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.47 -0.786 . . . . 2.52 110.24 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.5 ptt-85 -119.0 133.99 55.47 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.401 -0.592 . . . . 3.4700000000000002 109.401 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.419 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 96.2 m-85 -102.65 128.05 49.5 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.069 -0.514 . . . . 2.3999999999999999 109.906 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.9 mt -110.35 133.45 53.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.378 0.609 . . . . 3.2000000000000002 111.546 -179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -124.95 105.55 9.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.106 -0.952 . . . . 2.9700000000000002 108.508 178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 63.95 22.68 13.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.862 -0.608 . . . . 3.6400000000000001 110.87 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.17 -25.75 26.13 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.973 -0.632 . . . . 3.75 112.678 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -87.36 143.07 27.43 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.099 -0.334 . . . . 4.6699999999999999 110.099 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -82.16 140.33 33.82 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.257 0.551 . . . . 3.5499999999999998 110.706 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.6 mm -78.56 116.14 21.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.559 -0.746 . . . . 2.5499999999999998 111.082 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.15 162.57 26.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.016 -0.538 . . . . 2.8900000000000001 110.39 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.426 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 1.1 m-20 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.227 -0.442 . . . . 2.4399999999999999 111.222 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -92.21 -2.52 56.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.498 -0.319 . . . . 3.29 111.68 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.2 m170 -67.35 143.89 56.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.765 0.317 . . . . 3.27 110.877 -179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 75.6 p -120.27 155.84 55.67 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 116.307 -0.406 . . . . 2.5299999999999998 110.615 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.01 -11.05 28.69 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.39 2.06 . . . . 2.21 111.212 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -78.89 -38.92 36.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.504 -0.771 . . . . 2.9199999999999999 110.274 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 10.0 pt-20 -86.49 -179.15 6.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.462 -0.335 . . . . 3.1800000000000002 110.41 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 9.0 mt 72.07 -54.75 0.68 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.225 0.61 . . . . 3.04 111.674 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.85 36.36 0.67 Allowed Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 111.673 -0.571 . . . . 2.7599999999999998 111.673 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -71.07 132.37 45.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.9 0.381 . . . . 2.4100000000000001 110.453 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -124.79 -168.74 1.86 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.12 0.486 . . . . 3.4399999999999999 111.485 -179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -76.24 143.76 40.79 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.518 -0.764 . . . . 2.3399999999999999 109.681 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 60.59 28.12 17.81 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.421 . . . . 2.5499999999999998 110.893 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.92 147.15 43.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 2.2799999999999998 110.153 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 17.6 t -96.09 128.32 47.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.234 0.54 . . . . 2.1899999999999999 111.708 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.8 tt -125.57 112.81 32.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.742 -0.836 . . . . 1.8600000000000001 108.742 178.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 27' ' ' ILE . 75.8 mt-10 -88.64 141.45 28.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.736 -0.666 . . . . 2.8999999999999999 111.181 -178.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.1 p -119.41 137.52 53.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.075 -0.511 . . . . 2.3599999999999999 110.349 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -137.12 163.36 31.01 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.557 -0.534 . . . . 2.9399999999999999 109.557 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -95.81 139.43 32.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.686 0.279 . . . . 3.6299999999999999 110.48 -179.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -79.17 149.34 32.01 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 3.6099999999999999 110.289 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -58.59 -45.5 88.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 4.9199999999999999 110.841 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.7 p -72.05 -32.75 67.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.056 -0.52 . . . . 4.4100000000000001 110.277 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 69.73 15.04 70.78 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.682 -0.69 . . . . 3.73 112.296 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.936 0 N-CA-C 110.922 -0.871 . . . . 3.6800000000000002 110.922 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 110.182 -0.303 . . . . 7.46 110.182 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.652 HG11 ' HA ' ' A' ' 34' ' ' ILE . 12.0 t -77.01 150.2 6.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.213 -0.449 . . . . 2.6499999999999999 110.273 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -67.47 138.04 56.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.03 -0.532 . . . . 2.5 110.243 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.404 HG11 ' CE ' ' A' ' 37' ' ' LYS . 15.0 p -106.17 127.59 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-O 121.433 0.635 . . . . 2.1299999999999999 110.94 -179.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.491 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 18.4 mt -87.55 108.52 18.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.828 -0.624 . . . . 1.6100000000000001 109.502 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . 0.422 ' O ' HD23 ' B' ' 7' ' ' LEU . 22.8 m-20 -79.67 134.42 36.42 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.79 -0.448 . . . . 2.5299999999999998 109.79 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.422 HD23 ' O ' ' B' ' 6' ' ' ASP . 18.2 mt -119.35 27.25 8.91 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.479 0.657 . . . . 1.77 109.989 178.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . 0.576 ' HB ' ' CE2' ' A' ' 21' ' ' TYR . 1.4 t -74.9 -41.25 60.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.489 -0.778 . . . . 3.0 110.545 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 39.1 mm -66.47 116.6 5.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.086 -0.506 . . . . 3.7400000000000002 111.398 -178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -144.24 -67.43 0.33 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.684 -0.689 . . . . 6.2199999999999998 110.054 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 14.3 m -107.62 153.67 22.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.931 -0.577 . . . . 5.71 109.722 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 41.8 m -55.37 108.22 0.4 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 6.2300000000000004 111.189 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 4.4 p -165.53 -23.62 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.79 -0.641 . . . . 5.9000000000000004 111.762 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 19.0 t70 . . . . . 0 N--CA 1.463 0.216 0 C-N-CA 120.9 -0.32 . . . . 5.6200000000000001 110.975 -179.583 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' OH ' ' HA ' ' B' ' 10' ' ' GLU . 9.1 m-85 . . . . . 0 N--CA 1.48 1.056 0 N-CA-C 110.096 -0.335 . . . . 2.7200000000000002 110.096 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 10.9 mm -73.68 128.96 36.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.149 -0.478 . . . . 1.99 109.994 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 35.6 ttpt -112.43 118.59 35.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.442 -0.345 . . . . 3.0699999999999998 110.204 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 81.3 mt -102.67 150.29 23.59 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.334 -0.394 . . . . 1.3600000000000001 110.039 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -107.82 111.45 23.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.782 0.325 . . . . 2.7000000000000002 111.173 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 20.2 t -90.06 104.35 15.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.129 -0.693 . . . . 1.6200000000000001 109.129 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 20.1 mm -92.76 114.93 30.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.066 0.46 . . . . 2.3900000000000001 111.47 -178.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 170.05 34.56 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 115.771 -0.65 . . . . 2.6400000000000001 111.949 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -71.85 -16.59 62.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.135 0.493 . . . . 3.73 110.9 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -91.69 15.03 13.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.13 -0.486 . . . . 3.0699999999999998 110.747 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 42.9 m 68.14 30.17 5.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.582 -0.735 . . . . 3.25 111.708 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 55.7 p -99.18 140.69 32.96 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.494 -0.558 . . . . 2.4700000000000002 109.494 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.429 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 5.0 pt-20 -125.71 92.57 3.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.133 0.492 . . . . 2.9900000000000002 110.939 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.76 HD13 HG11 ' B' ' 2' ' ' VAL . 6.6 mm -81.22 139.3 18.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 108.767 -0.827 . . . . 1.8100000000000001 108.767 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.414 ' HB3' HG13 ' B' ' 4' ' ' VAL . 2.2 m-70 -95.64 147.61 23.4 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.871 -0.332 . . . . 2.04 110.32 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.602 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -125.62 117.11 22.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.324 -0.398 . . . . 1.53 111.164 -179.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.46 ' N ' HG12 ' B' ' 4' ' ' VAL . 3.6 mtmt -96.68 96.11 8.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.136 0.493 . . . . 2.3999999999999999 110.818 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.447 HG12 ' HB2' ' B' ' 7' ' ' LEU . 16.2 m -118.29 170.88 7.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.733 . . . . 1.5700000000000001 111.35 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.89 147.0 50.09 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.932 -0.766 . . . . 3.2000000000000002 108.932 178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.654 ' SD ' ' HB2' ' A' ' 77' ' ' PRO . 23.1 mmt -69.39 86.2 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.209 0.528 . . . . 3.0099999999999998 110.672 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.1 m -164.53 -52.32 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.529 -0.76 . . . . 2.21 109.622 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.05 147.66 34.66 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.261 -0.881 . . . . 1.75 111.484 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -69.37 165.58 20.46 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.154 -0.475 . . . . 2.4300000000000002 110.586 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.483 HD13 HD12 ' A' ' 71' ' ' ILE . 53.2 mt -70.99 -9.92 58.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.149 0.499 . . . . 1.8899999999999999 110.564 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG3' ' OD2' ' A' ' 73' ' ' ASP . 40.3 tttp -63.49 -38.01 89.49 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.236 -0.653 . . . . 2.4399999999999999 109.236 178.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -61.76 -36.38 80.87 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.316 -0.857 . . . . 2.0800000000000001 110.218 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -63.21 -39.52 94.87 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.603 -0.726 . . . . 2.54 110.391 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -70.6 -52.45 21.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.38 -0.827 . . . . 2.2599999999999998 112.206 -178.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.476 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 4.4 pt-20 -65.27 -47.04 78.08 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.884 0.698 . . . . 1.8799999999999999 112.884 -177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.462 ' N ' ' HG3' ' A' ' 49' ' ' GLU . 13.0 m -59.79 -39.26 84.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.711 0.291 . . . . 1.46 111.777 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.407 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 21.3 t80 -69.28 -41.06 77.34 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.632 -0.427 . . . . 1.6899999999999999 110.298 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 80.0 m -61.72 -40.78 96.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.327 -0.397 . . . . 1.99 110.634 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 49' ' ' GLU . 92.9 mt-30 -62.07 -41.78 98.52 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.226 0.536 . . . . 2.1699999999999999 109.955 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.457 ' NH1' HG12 ' B' ' 5' ' ' ILE . 23.4 ttt180 -64.86 -43.81 91.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.846 -0.615 . . . . 2.1699999999999999 110.573 179.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 13.5 mm100 -69.39 -25.33 64.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.946 0.403 . . . . 2.4100000000000001 110.466 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.71 40.36 8.28 Favored Glycine 0 N--CA 1.443 -0.878 0 N-CA-C 111.224 -0.75 . . . . 2.7400000000000002 111.224 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.4 m -135.99 155.75 77.53 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.292 . . . . 2.6600000000000001 110.21 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -63.45 148.46 92.62 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.87 2.38 . . . . 2.9300000000000002 112.126 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.476 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 12.6 ttt -76.44 61.32 1.7 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.498 0.666 . . . . 2.52 110.883 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.419 ' H ' ' H ' ' A' ' 61' ' ' SER . 1.9 t-20 -170.1 -18.36 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.446 -0.797 . . . . 3.6499999999999999 109.735 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.419 ' H ' ' H ' ' A' ' 60' ' ' ASN . 1.4 m -82.31 -12.05 58.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 2.8700000000000001 111.583 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 64.2 mt -121.64 139.32 53.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.05 0.453 . . . . 2.52 111.177 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.406 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 19.9 ptt-85 -118.15 129.0 55.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.993 -0.549 . . . . 3.4700000000000002 109.565 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -97.68 126.98 43.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.982 -0.553 . . . . 2.3999999999999999 110.309 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 81.9 mt -113.88 137.12 52.11 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.052 -0.522 . . . . 3.2000000000000002 110.851 -179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -127.17 100.38 6.07 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.495 -0.928 . . . . 2.9700000000000002 108.495 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 65.55 31.79 9.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.634 -0.712 . . . . 3.6400000000000001 110.555 -179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.74 -28.04 15.24 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.733 -0.667 . . . . 3.75 112.701 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -87.71 135.4 33.39 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.225 -0.287 . . . . 4.6699999999999999 110.225 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -75.56 142.16 42.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.469 0.652 . . . . 3.5499999999999998 111.328 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.483 HD12 HD13 ' A' ' 44' ' ' LEU . 30.3 mm -79.59 117.38 25.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.268 -0.878 . . . . 2.5499999999999998 110.925 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.45 ' HB3' ' ND1' ' A' ' 75' ' ' HIS . . . -84.81 154.9 22.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.048 -0.524 . . . . 2.8900000000000001 110.229 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.412 ' OD2' ' HG3' ' A' ' 45' ' ' LYS . 1.0 OUTLIER -66.99 -27.75 67.69 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.993 -0.548 . . . . 2.4399999999999999 111.744 -179.051 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -89.4 4.25 49.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 3.29 111.503 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.45 ' ND1' ' HB3' ' A' ' 72' ' ' ALA . 0.6 OUTLIER -86.37 149.16 25.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.336 0.589 . . . . 3.27 111.378 -179.35 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.1 p -117.42 157.95 46.11 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.502 -0.772 . . . . 2.5299999999999998 110.09 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.654 ' HB2' ' SD ' ' A' ' 40' ' ' MET . 17.0 Cg_exo -67.0 -10.71 29.54 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.441 2.094 . . . . 2.21 111.952 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -79.46 -17.56 53.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.366 0.603 . . . . 2.9199999999999999 109.79 179.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -98.01 164.14 12.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.661 -0.699 . . . . 3.1800000000000002 110.26 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 86.6 mt 68.68 -1.13 2.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.888 -0.597 . . . . 3.04 111.944 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.07 45.53 55.96 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.81 -0.71 . . . . 2.7599999999999998 112.868 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 3.6 ttt -72.53 125.4 27.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.811 0.338 . . . . 2.4100000000000001 110.229 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -114.18 -171.53 1.93 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.467 0.543 . . . . 3.4399999999999999 112.467 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -72.94 137.45 45.53 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.499 -0.773 . . . . 2.3399999999999999 110.229 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 54.76 38.7 30.61 Favored 'General case' 0 CA--C 1.516 -0.348 0 O-C-N 123.797 0.686 . . . . 2.5499999999999998 110.863 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.02 160.11 33.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.609 -0.723 . . . . 2.2799999999999998 110.404 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 99.3 t -99.16 114.06 35.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.394 0.616 . . . . 2.1899999999999999 112.208 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.7 tt -120.32 132.31 70.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 N-CA-C 108.277 -1.008 . . . . 1.8600000000000001 108.277 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -111.66 144.05 41.57 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.916 0.389 . . . . 2.8999999999999999 111.28 -178.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.5 p -124.62 129.54 73.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.078 -0.51 . . . . 2.3599999999999999 110.421 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -130.92 159.72 36.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.23 -0.441 . . . . 2.9399999999999999 110.121 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -79.95 139.59 37.0 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.864 0.364 . . . . 3.6299999999999999 111.026 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.406 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.4 mm-40 -77.38 149.83 35.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.914 -0.585 . . . . 3.6099999999999999 110.855 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -73.17 -32.68 64.99 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.874 -0.603 . . . . 4.9199999999999999 110.317 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 p -65.18 -57.18 9.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.908 -0.587 . . . . 4.4100000000000001 110.128 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.35 -20.31 18.82 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.756 -0.656 . . . . 3.73 112.493 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.75 -1.028 . . . . 3.6800000000000002 111.807 -179.904 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.748 0.309 . . . . 7.46 110.424 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.76 HG11 HD13 ' A' ' 34' ' ' ILE . 46.5 t -76.85 149.26 6.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.238 -0.437 . . . . 2.6499999999999999 110.655 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.61 148.28 51.61 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.803 -0.635 . . . . 2.5 111.426 -179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.46 HG12 ' N ' ' A' ' 37' ' ' LYS . 2.2 t -99.16 120.12 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 CA-C-N 115.517 -0.765 . . . . 2.1299999999999999 109.671 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.483 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 9.6 mt -71.77 108.71 3.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 1.6100000000000001 109.707 179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -73.94 107.6 6.26 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 116.157 -0.474 . . . . 2.5299999999999998 110.466 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.447 ' HB2' HG12 ' A' ' 38' ' ' VAL . 12.0 mt -100.88 -20.03 15.66 Favored 'General case' 0 C--N 1.314 -0.947 0 C-N-CA 119.455 -0.898 . . . . 1.77 109.966 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 1.7 m -122.62 124.31 43.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.767 -0.651 . . . . 3.0 110.343 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 7.6 tp -74.58 147.36 8.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.958 -0.565 . . . . 3.7400000000000002 110.889 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.501 ' HA ' ' OH ' ' A' ' 21' ' ' TYR . 42.6 mt-10 -81.28 -51.66 8.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.992 0.425 . . . . 6.2199999999999998 110.72 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.28 162.06 28.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.826 -0.625 . . . . 5.71 110.867 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.95 -52.41 4.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.773 0.32 . . . . 6.2300000000000004 111.377 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 5.4 m -88.32 -28.61 20.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.486 -0.324 . . . . 5.9000000000000004 111.251 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 t70 . . . . . 0 C--N 1.324 -0.543 0 CA-C-O 120.929 0.395 . . . . 5.6200000000000001 110.223 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.464 ' CD1' HG21 ' B' ' 8' ' ' THR . 9.6 m-85 . . . . . 0 N--CA 1.483 1.216 0 N-CA-C 110.09 -0.337 . . . . 2.7200000000000002 110.09 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 38.4 mm -95.27 131.57 41.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.622 -0.51 . . . . 1.99 109.622 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.712 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -102.5 145.84 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.157 0.503 . . . . 3.0699999999999998 111.689 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.0 mt -131.0 128.86 41.22 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.493 -0.776 . . . . 1.3600000000000001 109.26 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -93.78 109.91 21.57 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.847 0.356 . . . . 2.7000000000000002 110.464 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 12.4 t -85.55 123.2 39.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.756 -0.657 . . . . 1.6200000000000001 110.747 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 21.6 mm -109.93 116.7 52.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.685 -0.689 . . . . 2.3900000000000001 110.117 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.65 -179.93 43.33 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.75 -0.738 . . . . 2.6400000000000001 112.275 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -65.88 -28.48 68.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 3.73 110.617 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -86.21 13.56 7.77 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.107 -0.497 . . . . 3.0699999999999998 110.606 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.6 m 59.78 48.63 8.93 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.833 0.825 . . . . 3.25 110.327 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.57 166.42 16.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.954 -1.021 . . . . 2.4700000000000002 109.815 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' B' ' 2' ' ' VAL . 8.9 tt0 -137.53 97.07 3.37 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.023 0.44 . . . . 2.9900000000000002 110.243 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.7 mm -116.23 127.63 73.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.554 . . . . 1.8100000000000001 109.58 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.644 ' HB3' HG13 ' B' ' 4' ' ' VAL . 0.0 OUTLIER -88.81 166.67 13.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.141 0.495 . . . . 2.04 110.826 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.712 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -143.39 131.11 21.36 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 122.246 -0.284 . . . . 1.53 111.71 -179.062 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -99.09 95.2 6.96 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.061 -0.348 . . . . 2.3999999999999999 110.061 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.9 m -117.35 171.58 5.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 1.5700000000000001 111.465 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.63 148.35 50.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.542 -0.54 . . . . 3.2000000000000002 109.542 178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 26.6 mtt -83.96 85.33 7.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.225 0.536 . . . . 3.0099999999999998 111.032 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 16.3 m -167.74 -46.9 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.294 -1.002 . . . . 2.21 108.294 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.52 148.07 37.35 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.716 -1.129 . . . . 1.75 110.882 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.431 ' HA ' HG22 ' A' ' 76' ' ' THR . 1.4 m-70 -66.67 155.27 38.43 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.295 -0.412 . . . . 2.4300000000000002 110.648 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.8 mt -69.5 -9.96 56.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.042 0.449 . . . . 1.8899999999999999 110.3 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.553 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 17.8 ttpp -61.51 -40.23 93.87 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.486 -0.779 . . . . 2.4399999999999999 109.103 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.3 tptp -62.6 -39.87 95.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.349 -0.841 . . . . 2.0800000000000001 109.95 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.13 -44.39 87.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 2.54 110.201 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -68.88 -54.59 14.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.604 -0.726 . . . . 2.2599999999999998 112.356 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 9.4 pt-20 -62.67 -42.58 99.69 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.788 0.662 . . . . 1.8799999999999999 112.788 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.501 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 9.4 m -65.67 -34.54 78.45 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.816 -0.354 . . . . 1.46 111.22 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.49 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 7.0 t80 -70.87 -40.69 72.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.525 -0.546 . . . . 1.6899999999999999 109.525 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 79.8 m -61.5 -35.22 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.223 -0.444 . . . . 1.99 109.896 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.501 ' OE1' ' HA ' ' A' ' 50' ' ' SER . 72.8 mt-30 -63.44 -38.12 89.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.69 -0.686 . . . . 2.1699999999999999 110.363 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.445 ' NH1' HG12 ' B' ' 5' ' ' ILE . 2.4 ttt180 -76.05 -38.45 57.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.367 -0.379 . . . . 2.1699999999999999 110.334 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 10.8 mm100 -69.61 -22.79 63.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.063 0.459 . . . . 2.4100000000000001 110.251 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.28 27.24 40.69 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.005 -0.617 . . . . 2.7400000000000002 112.506 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.2 m -117.56 153.13 50.36 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-O 120.547 0.213 . . . . 2.6600000000000001 110.814 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.79 173.97 11.1 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.399 2.066 . . . . 2.9300000000000002 111.836 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 9.4 tpt -74.57 148.94 40.37 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.649 -0.25 . . . . 2.52 110.753 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 70.06 16.72 7.48 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.636 -0.711 . . . . 3.6499999999999999 112.167 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.5 p -92.42 -26.62 17.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.242 0.544 . . . . 2.8700000000000001 109.698 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 36.7 mt -121.22 146.28 46.96 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.579 -0.737 . . . . 2.52 110.227 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.444 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 25.5 ptt-85 -119.3 131.26 55.72 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.142 -0.688 . . . . 3.4700000000000002 109.142 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 70' ' ' ARG . 73.1 m-85 -99.87 133.83 43.66 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.964 -0.562 . . . . 2.3999999999999999 110.675 -178.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 82.7 mt -115.89 131.74 56.85 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.961 -0.563 . . . . 3.2000000000000002 110.665 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -134.97 114.49 12.55 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.424 -0.807 . . . . 2.9700000000000002 109.069 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 62.98 23.2 13.89 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.09 0.472 . . . . 3.6400000000000001 110.798 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.42 -12.55 68.74 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.953 -0.642 . . . . 3.75 112.452 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -103.51 138.48 40.16 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.663 -0.316 . . . . 4.6699999999999999 110.279 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 13.2 ptm180 -76.28 142.37 41.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.136 0.493 . . . . 3.5499999999999998 110.476 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 46.3 mm -75.75 117.8 20.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.798 -0.637 . . . . 2.5499999999999998 111.811 -179.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.32 157.39 18.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.663 -0.698 . . . . 2.8900000000000001 109.64 178.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -67.85 -29.08 68.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.317 0.58 . . . . 2.4399999999999999 110.629 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -82.73 -4.42 57.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.697 -0.683 . . . . 3.29 111.177 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -81.76 145.46 30.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.105 0.479 . . . . 3.27 111.058 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 21.1 p -127.47 161.07 56.98 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 2.5299999999999998 109.7 178.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -65.39 -11.5 30.55 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.367 2.045 . . . . 2.21 111.923 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.41 -36.17 71.24 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.829 -0.623 . . . . 2.9199999999999999 110.313 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 76' ' ' THR . 4.2 pt-20 -97.95 -178.68 4.16 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.433 -0.581 . . . . 3.1800000000000002 109.433 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 23.7 mt 73.92 -49.94 0.68 Allowed 'General case' 0 N--CA 1.47 0.542 0 O-C-N 123.666 0.604 . . . . 3.04 110.896 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.06 50.74 0.62 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.998 -0.62 . . . . 2.7599999999999998 112.137 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 33.3 mtt -77.39 137.23 38.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.855 0.36 . . . . 2.4100000000000001 110.778 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -122.79 174.13 7.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.11 -0.496 . . . . 3.4399999999999999 110.465 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -63.98 129.03 38.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.188 -0.46 . . . . 2.3399999999999999 110.898 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 58.26 49.36 11.26 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.295 0.569 . . . . 2.5499999999999998 110.879 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -79.31 178.58 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.652 -0.703 . . . . 2.2799999999999998 110.232 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 53.3 t -117.74 131.79 69.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.834 0.35 . . . . 2.1899999999999999 111.181 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.411 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 17.0 tt -134.81 132.5 53.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.288 -0.634 . . . . 1.8600000000000001 109.288 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -98.42 151.69 20.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.77 0.319 . . . . 2.8999999999999999 111.466 -178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.2 p -131.32 127.02 59.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.045 -0.525 . . . . 2.3599999999999999 110.353 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -132.05 160.54 35.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.949 -0.569 . . . . 2.9399999999999999 109.823 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -85.65 145.55 27.26 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.874 0.368 . . . . 3.6299999999999999 110.945 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.444 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 5.2 mm-40 -84.62 133.27 34.42 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.179 -0.464 . . . . 3.6099999999999999 110.91 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -64.6 -28.47 69.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.859 -0.61 . . . . 4.9199999999999999 110.353 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -15.87 63.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 4.4100000000000001 111.458 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.07 -55.04 3.28 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.004 -0.617 . . . . 3.73 112.104 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.627 -1.096 . . . . 3.6800000000000002 111.518 179.903 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 87.2 mttt . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.653 0.263 . . . . 7.46 110.409 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.477 HG12 ' N ' ' A' ' 35' ' ' HIS . 0.4 OUTLIER -102.97 106.67 20.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 N-CA-C 109.397 -0.594 . . . . 2.6499999999999999 109.397 179.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -97.97 128.76 44.73 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.745 -0.662 . . . . 2.5 110.16 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.644 HG13 ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -85.14 106.74 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.614 0 N-CA-C 109.879 -0.415 . . . . 2.1299999999999999 109.879 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.589 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 23.4 mt -69.93 122.0 20.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 109.073 -0.714 . . . . 1.6100000000000001 109.073 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -70.26 106.71 3.43 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.688 -0.687 . . . . 2.5299999999999998 111.836 -178.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 8.4 mt -118.01 -14.2 9.99 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.502 -0.555 . . . . 1.77 109.502 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . 0.464 HG21 ' CD1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -83.8 20.07 1.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.929 -0.578 . . . . 3.0 111.238 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 40.5 pt -66.74 -33.82 65.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.181 0.515 . . . . 3.7400000000000002 109.769 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -103.06 101.56 11.54 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.604 -0.725 . . . . 6.2199999999999998 109.906 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 3.0 t -132.61 -54.71 0.95 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.783 -0.644 . . . . 5.71 109.608 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 58.6 m -122.92 -13.39 7.85 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.965 0.412 . . . . 6.2300000000000004 110.879 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 1.4 m -126.37 153.92 44.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.315 -0.402 . . . . 5.9000000000000004 110.334 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.037 -0.529 . . . . 5.6200000000000001 110.9 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.465 ' CD2' HG21 ' B' ' 8' ' ' THR . 16.8 m-85 . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 109.822 -0.436 . . . . 2.7200000000000002 109.822 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.428 ' O ' HG22 ' A' ' 38' ' ' VAL . 45.1 mm -75.31 130.38 36.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.913 0.387 . . . . 1.99 110.901 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -110.23 126.81 54.53 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.872 0.368 . . . . 3.0699999999999998 110.62 179.124 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 71.9 mt -104.38 132.77 50.26 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.242 -0.651 . . . . 1.3600000000000001 109.242 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 86' ' ' ASP . 1.7 ptpm? -99.5 113.42 25.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 2.7000000000000002 110.598 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.648 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 5.2 t -83.41 121.1 35.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.064 -0.971 . . . . 1.6200000000000001 110.003 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.533 ' HA ' ' O ' ' A' ' 32' ' ' SER . 43.2 mm -105.78 124.76 61.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.254 -0.43 . . . . 2.3900000000000001 110.946 -179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.4 178.82 35.76 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.826 -0.624 . . . . 2.6400000000000001 112.187 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -70.01 -31.03 68.49 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 3.73 111.03 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -87.61 24.46 1.69 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.937 0.399 . . . . 3.0699999999999998 111.085 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.5 m 62.01 37.96 14.51 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.636 -0.711 . . . . 3.25 111.649 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.533 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 1.2 p -91.07 145.96 24.25 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.212 -0.449 . . . . 2.4700000000000002 110.363 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -127.76 118.8 24.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.978 0.418 . . . . 2.9900000000000002 110.315 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.2 mt -120.27 130.57 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.869 -0.605 . . . . 1.8100000000000001 109.482 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.668 ' O ' ' HA ' ' B' ' 4' ' ' VAL . 14.6 m170 -88.21 148.53 24.33 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.166 0.508 . . . . 2.04 110.987 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 23' ' ' LYS . 0.6 OUTLIER -133.65 113.09 11.99 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.135 -0.484 . . . . 1.53 110.852 -178.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.445 ' HB2' HG22 ' B' ' 4' ' ' VAL . 6.1 ttmt -81.36 101.42 9.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.309 -0.405 . . . . 2.3999999999999999 110.431 179.081 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.428 HG22 ' O ' ' A' ' 22' ' ' ILE . 5.3 m -108.06 156.88 8.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.361 . . . . 1.5700000000000001 110.718 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.771 ' HB2' HG22 ' B' ' 8' ' ' THR . 37.4 tttm -113.83 129.66 56.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.193 -0.458 . . . . 3.2000000000000002 109.89 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 55.7 ttp -71.44 85.53 0.83 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.287 0.565 . . . . 3.0099999999999998 110.263 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 21.8 m -165.04 -59.42 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.33 -0.85 . . . . 2.21 109.082 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.77 149.45 29.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.346 -0.843 . . . . 1.75 111.134 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.71 -178.92 2.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.154 -0.475 . . . . 2.4300000000000002 110.37 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.406 HD13 HG23 ' A' ' 71' ' ' ILE . 1.5 mt -78.34 -3.37 42.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.438 -0.346 . . . . 1.8899999999999999 111.27 -179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -61.73 -53.24 58.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.991 0.424 . . . . 2.4399999999999999 110.179 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -65.43 -36.16 83.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.874 -0.603 . . . . 2.0800000000000001 110.721 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.62 -43.34 99.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.916 -0.583 . . . . 2.54 111.274 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -66.64 -50.34 63.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.209 0.448 . . . . 2.2599999999999998 112.209 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.4 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 6.7 pt-20 -64.55 -43.53 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.68 0.622 . . . . 1.8799999999999999 112.68 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 6.3 m -64.62 -33.07 75.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.61 0.243 . . . . 1.46 111.361 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -68.6 -42.46 78.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.907 -0.405 . . . . 1.6899999999999999 109.907 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.34 -35.33 78.76 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 1.99 110.809 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.4 -35.85 82.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 2.1699999999999999 110.453 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -72.17 -34.54 68.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 2.1699999999999999 110.76 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -81.31 -13.62 58.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 2.4100000000000001 110.497 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.09 39.67 44.64 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.163 -0.542 . . . . 2.7400000000000002 112.63 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.6 m -137.5 156.0 75.14 Favored Pre-proline 0 C--N 1.328 -0.351 0 N-CA-C 110.408 -0.219 . . . . 2.6600000000000001 110.408 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.31 146.8 90.61 Favored 'Trans proline' 0 C--O 1.233 0.246 0 C-N-CA 122.666 2.244 . . . . 2.9300000000000002 112.645 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.4 ' SD ' ' HB3' ' A' ' 49' ' ' GLU . 5.2 ttt -78.5 55.29 1.59 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.892 -0.594 . . . . 2.52 111.097 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -156.87 -16.12 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.112 -0.494 . . . . 3.6499999999999999 111.167 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.7 p -96.62 -8.61 31.25 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.119 -0.232 . . . . 2.8700000000000001 111.256 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 23.0 mt -115.35 126.74 54.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.9 0.381 . . . . 2.52 110.633 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.1 ptt-85 -115.06 128.67 56.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 3.4700000000000002 110.019 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -96.14 132.78 41.19 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.785 -0.643 . . . . 2.3999999999999999 109.65 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.5 mt -118.29 142.58 47.35 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.027 0.442 . . . . 3.2000000000000002 111.319 -178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -135.43 107.06 6.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.278 -0.874 . . . . 2.9700000000000002 109.034 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 61.09 34.04 19.26 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.052 0.454 . . . . 3.6400000000000001 111.175 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.57 -19.76 42.38 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.018 -0.611 . . . . 3.75 112.759 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mm-40 -89.9 133.86 34.53 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.15 -0.315 . . . . 4.6699999999999999 110.15 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.1 ptm85 -77.76 138.4 38.99 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.299 -0.56 . . . . 3.5499999999999998 110.324 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.406 HG23 HD13 ' A' ' 44' ' ' LEU . 42.3 mm -79.27 111.35 16.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.648 -0.706 . . . . 2.5499999999999998 111.267 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.29 162.77 22.17 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.703 -0.68 . . . . 2.8900000000000001 109.832 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -64.88 -30.85 71.87 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.862 -0.608 . . . . 2.4399999999999999 111.476 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -82.84 4.22 26.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 3.29 112.031 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.2 m170 -81.05 164.96 22.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.826 0.346 . . . . 3.27 110.841 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.429 ' O ' ' HG2' ' A' ' 79' ' ' GLU . 8.9 t -155.77 146.21 16.03 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.438 -0.579 . . . . 2.5299999999999998 109.438 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.56 -17.07 16.0 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.953 2.435 . . . . 2.21 112.927 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 tppt? -73.32 -15.83 61.38 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.228 -0.442 . . . . 2.9199999999999999 110.787 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 12.5 pt-20 -119.38 171.4 8.36 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 3.1800000000000002 109.496 178.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 92.2 mt 73.13 -3.23 2.5 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.668 0.605 . . . . 3.04 111.153 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 70.81 47.3 40.58 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 121.033 -0.604 . . . . 2.7599999999999998 113.053 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 10.1 mtt -73.2 131.57 42.16 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.858 -0.423 . . . . 2.4100000000000001 109.858 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 46.1 mt-10 -119.93 178.7 4.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.068 0.461 . . . . 3.4399999999999999 111.606 -178.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -67.92 138.83 56.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.483 -0.78 . . . . 2.3399999999999999 110.535 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 57.59 39.05 27.98 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 123.593 0.558 . . . . 2.5499999999999998 110.641 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 25' ' ' LYS . 1.0 OUTLIER -77.47 164.76 25.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.015 -0.538 . . . . 2.2799999999999998 110.39 -179.803 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.0 t -103.19 132.86 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.144 0.497 . . . . 2.1899999999999999 111.877 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.648 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 15.6 tt -132.98 127.82 55.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 108.691 -0.855 . . . . 1.8600000000000001 108.691 178.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -103.89 142.14 34.92 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.69 0.281 . . . . 2.8999999999999999 111.036 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.9 p -121.43 126.96 75.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.162 0.506 . . . . 2.3599999999999999 110.206 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -130.72 165.46 22.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.896 -0.593 . . . . 2.9399999999999999 109.693 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -96.24 139.05 32.95 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.943 0.402 . . . . 3.6299999999999999 110.906 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.92 146.5 39.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.873 -0.603 . . . . 3.6099999999999999 109.584 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -69.42 -25.7 64.25 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.433 -0.349 . . . . 4.9199999999999999 111.303 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.93 -18.51 62.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.232 -0.44 . . . . 4.4100000000000001 111.437 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.88 -1.27 79.77 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.809 -0.71 . . . . 3.73 112.593 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.944 -0.92 . . . . 3.6800000000000002 111.337 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 29.4 tttt . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 110.174 -0.306 . . . . 7.46 110.174 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.0 t -80.67 104.02 8.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 N-CA-C 108.935 -0.765 . . . . 2.6499999999999999 108.935 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -119.92 112.81 19.66 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 107.949 -1.13 . . . . 2.5 107.949 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.668 ' HA ' ' O ' ' A' ' 35' ' ' HIS . 12.2 p -84.74 110.75 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.826 0 CA-C-O 122.062 0.934 . . . . 2.1299999999999999 110.624 -177.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.446 ' HB ' ' CD1' ' A' ' 36' ' ' PHE . 6.4 mt -77.81 117.2 22.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 114.607 -1.179 . . . . 1.6100000000000001 109.859 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -77.29 106.31 8.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.805 0.336 . . . . 2.5299999999999998 110.909 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.413 HD22 ' CZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -112.92 11.23 19.1 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.521 0.676 . . . . 1.77 109.346 178.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . 0.771 HG22 ' HB2' ' A' ' 39' ' ' LYS . 67.3 p -93.36 8.85 38.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.229 -0.896 . . . . 3.0 110.225 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 7.2 tp -61.54 124.74 16.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.459 -0.792 . . . . 3.7400000000000002 111.374 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.5 -30.42 7.14 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.329 -0.85 . . . . 6.2199999999999998 110.019 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 7.2 m -82.97 -178.9 7.28 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.256 -0.883 . . . . 5.71 110.776 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 1.4 m -86.56 -27.05 24.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.551 0.215 . . . . 6.2300000000000004 111.435 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.63 107.04 5.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.673 0.273 . . . . 5.9000000000000004 110.855 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.039 -0.528 . . . . 5.6200000000000001 110.877 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.45 ' CD2' HG22 ' B' ' 8' ' ' THR . 12.6 m-85 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 110.005 -0.368 . . . . 2.7200000000000002 110.005 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 12.8 mm -79.4 142.46 13.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.353 -0.385 . . . . 1.99 111.204 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -121.28 119.27 31.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.343 -0.389 . . . . 3.0699999999999998 110.046 178.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 87.1 mt -103.51 144.59 31.21 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.221 -0.445 . . . . 1.3600000000000001 110.0 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 mttp -99.81 103.08 14.68 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.313 -0.403 . . . . 2.7000000000000002 110.625 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 88' ' ' ILE . 11.0 t -88.03 124.94 41.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.922 -0.581 . . . . 1.6200000000000001 109.534 179.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 32' ' ' SER . 10.8 mm -119.37 137.41 53.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.014 0.435 . . . . 2.3900000000000001 111.533 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -112.18 172.76 14.96 Favored Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.923 -0.58 . . . . 2.6400000000000001 111.969 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 31.6 tp60 -65.52 -20.36 66.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.166 0.507 . . . . 3.73 111.325 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -89.31 18.42 5.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.389 -0.369 . . . . 3.0699999999999998 110.678 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.4 m 59.36 39.93 21.64 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.67 -0.696 . . . . 3.25 111.239 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' ILE . 2.0 p -91.01 142.86 27.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.766 -0.652 . . . . 2.4700000000000002 110.174 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -121.97 114.69 21.32 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.06 0.457 . . . . 2.9900000000000002 110.063 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.4 mm -126.03 133.55 68.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.979 -0.555 . . . . 1.8100000000000001 110.473 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.644 ' HB3' HG13 ' B' ' 4' ' ' VAL . 0.2 OUTLIER -91.99 150.2 21.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.061 0.458 . . . . 2.04 110.219 179.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.549 ' HE1' HD13 ' B' ' 7' ' ' LEU . 0.1 OUTLIER -131.11 108.58 9.85 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.315 -0.402 . . . . 1.53 111.832 -178.873 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.576 ' HG3' HG11 ' B' ' 4' ' ' VAL . 11.8 mtmt -81.58 101.51 10.04 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.749 -0.463 . . . . 2.3999999999999999 109.749 178.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.464 HG11 HD23 ' A' ' 47' ' ' LEU . 17.1 m -115.85 166.94 9.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.175 0.512 . . . . 1.5700000000000001 112.287 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HD3' ' HB2' ' B' ' 10' ' ' GLU . 53.4 tttp -115.04 136.51 53.04 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.322 -0.854 . . . . 3.2000000000000002 108.987 179.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 43.4 ttp -78.3 85.31 4.44 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.754 0.311 . . . . 3.0099999999999998 110.495 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.45 -44.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.605 -0.725 . . . . 2.21 109.853 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.91 148.17 36.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.683 -0.69 . . . . 1.75 111.266 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -67.17 167.85 11.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 2.4300000000000002 110.362 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.409 HD13 HD12 ' A' ' 71' ' ' ILE . 78.7 mt -75.29 -3.81 35.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 1.8899999999999999 111.08 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.88 -47.2 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.261 -0.644 . . . . 2.4399999999999999 109.261 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 16.9 tptp -57.09 -40.1 76.32 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.272 -0.876 . . . . 2.0800000000000001 110.73 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.464 HD23 HG11 ' A' ' 38' ' ' VAL . 1.4 tm? -57.03 -39.2 74.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.587 -0.733 . . . . 2.54 110.895 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -79.0 -55.33 5.21 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.8 -0.636 . . . . 2.2599999999999998 112.518 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -44.48 94.91 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.017 0.747 . . . . 1.8799999999999999 113.017 -177.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.606 ' HB3' HD11 ' B' ' 7' ' ' LEU . 63.3 m -62.91 -35.33 79.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.624 0.193 . . . . 1.46 111.229 -179.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -66.9 -45.35 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.577 -0.527 . . . . 1.6899999999999999 109.577 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 59.5 m -62.17 -37.36 84.96 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.823 -0.626 . . . . 1.99 110.342 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -61.32 -44.45 97.18 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-N 115.975 -0.557 . . . . 2.1699999999999999 111.13 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.417 ' CZ ' HG12 ' B' ' 5' ' ' ILE . 10.4 ttp180 -76.41 -24.49 54.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.846 0.355 . . . . 2.1699999999999999 110.837 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -75.48 -33.79 60.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.361 -0.382 . . . . 2.4100000000000001 110.266 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 96.44 32.34 6.7 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.766 -0.652 . . . . 2.7400000000000002 111.851 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.21 152.26 79.83 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 122.928 -0.16 . . . . 2.6600000000000001 110.595 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.47 154.39 74.51 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.646 2.231 . . . . 2.9300000000000002 112.129 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.497 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 11.3 tpt -66.59 145.53 55.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.256 -0.429 . . . . 2.52 110.572 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 59' ' ' MET . 6.3 m120 76.54 10.18 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.523 0.729 . . . . 3.6499999999999999 112.344 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.7 p -90.38 -17.71 26.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.297 -0.631 . . . . 2.8700000000000001 109.297 178.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 92' ' ' GLN . 72.6 mt -124.15 149.13 46.64 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.362 -0.835 . . . . 2.52 110.092 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.529 ' HD3' ' OE1' ' A' ' 93' ' ' GLU . 32.5 ptt-85 -119.2 128.61 54.38 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.042 0.449 . . . . 3.4700000000000002 109.886 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.411 ' HB3' HD11 ' A' ' 88' ' ' ILE . 68.3 m-85 -95.81 132.71 40.77 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.946 -0.57 . . . . 2.3999999999999999 109.841 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.8 mt -112.47 138.59 49.01 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.212 0.529 . . . . 3.2000000000000002 111.307 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -138.41 110.12 7.12 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 2.9700000000000002 108.51 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 64.52 31.92 12.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.939 -0.573 . . . . 3.6400000000000001 110.873 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.53 -31.53 6.72 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.858 -0.686 . . . . 3.75 113.173 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -87.62 161.41 17.71 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.435 -0.209 . . . . 4.6699999999999999 110.435 -179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 70' ' ' ARG . 11.2 ptm180 -94.04 143.66 26.17 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.968 0.413 . . . . 3.5499999999999998 110.584 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.409 HD12 HD13 ' A' ' 44' ' ' LEU . 30.4 mm -78.46 121.57 31.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.858 -0.61 . . . . 2.5499999999999998 111.81 -179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -88.74 157.19 18.59 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.989 -0.55 . . . . 2.8900000000000001 109.891 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -68.9 -22.28 64.18 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.385 -0.37 . . . . 2.4399999999999999 111.884 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -95.17 8.68 42.29 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.682 0.277 . . . . 3.29 111.625 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -90.79 153.42 20.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.777 0.322 . . . . 3.27 110.403 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.6 p -123.18 161.38 45.31 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.236 -0.438 . . . . 2.5299999999999998 111.307 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -68.54 -17.89 43.32 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.685 2.257 . . . . 2.21 111.845 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -72.1 -42.49 66.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.895 -0.593 . . . . 2.9199999999999999 110.546 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.425 ' HG3' ' HG ' ' A' ' 80' ' ' LEU . 15.1 pt-20 -84.09 176.01 9.1 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.102 -0.499 . . . . 3.1800000000000002 110.243 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.425 ' HG ' ' HG3' ' A' ' 79' ' ' GLU . 33.1 mt 73.38 -42.56 0.53 Allowed 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.502 0.721 . . . . 3.04 111.88 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 107.41 54.29 0.66 Allowed Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.648 -0.581 . . . . 2.7599999999999998 111.648 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 49.7 ttm -90.47 115.58 27.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.955 0.407 . . . . 2.4100000000000001 110.15 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 34.5 mt-10 -103.53 -178.74 3.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.065 -0.516 . . . . 3.4399999999999999 111.375 -178.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.523 ' HG3' ' HG2' ' A' ' 85' ' ' GLU . 10.1 tp10 -73.4 142.81 46.96 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.109 -0.7 . . . . 2.3399999999999999 109.109 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.523 ' HG2' ' HG3' ' A' ' 84' ' ' GLU . 81.2 mm-40 60.32 41.27 16.59 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.194 0.521 . . . . 2.5499999999999998 109.923 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.4 t0 -85.55 172.46 10.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.967 -0.56 . . . . 2.2799999999999998 110.973 -179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.4 t -117.92 138.72 47.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.04 0.447 . . . . 2.1899999999999999 111.668 -178.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.524 ' O ' ' HA ' ' A' ' 26' ' ' VAL . 10.4 tt -142.54 127.92 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.536 -0.756 . . . . 1.8600000000000001 109.035 178.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -97.95 160.0 14.58 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.896 0.379 . . . . 2.8999999999999999 111.452 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 p -138.1 127.57 33.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.935 -0.575 . . . . 2.3599999999999999 109.916 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -132.85 153.21 51.54 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.455 -0.339 . . . . 2.9399999999999999 110.392 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.545 ' HA ' HD23 ' A' ' 62' ' ' LEU . 5.6 tt0 -78.48 134.57 37.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.281 -0.418 . . . . 3.6299999999999999 110.91 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.529 ' OE1' ' HD3' ' A' ' 63' ' ' ARG . 6.9 mm-40 -78.01 143.19 37.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.182 -0.463 . . . . 3.6099999999999999 110.026 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -62.35 -23.75 66.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.95 -0.568 . . . . 4.9199999999999999 111.001 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.4 p -71.84 -30.37 65.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.782 -0.645 . . . . 4.4100000000000001 110.763 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.91 15.07 81.66 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.761 -0.654 . . . . 3.73 112.233 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.88 0 CA-C-O 119.161 -0.799 . . . . 3.6800000000000002 111.346 -179.858 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 17.1 mtpp . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.746 0.307 . . . . 7.46 110.214 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.7 m -96.68 110.86 25.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 116.191 -0.459 . . . . 2.6499999999999999 110.535 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -73.72 122.13 21.88 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.451 -0.944 . . . . 2.5 108.451 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.644 HG13 ' HB3' ' A' ' 35' ' ' HIS . 1.9 t -93.42 107.0 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 CA-C-O 120.9 0.381 . . . . 2.1299999999999999 111.163 -178.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.528 ' HB ' ' CE1' ' A' ' 36' ' ' PHE . 16.2 mt -70.91 128.67 34.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.077 -0.712 . . . . 1.6100000000000001 109.077 178.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -80.6 105.85 12.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.832 0.348 . . . . 2.5299999999999998 111.147 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.606 HD11 ' HB3' ' A' ' 50' ' ' SER . 1.3 tp -119.07 18.83 13.08 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.452 -0.944 . . . . 1.77 108.452 177.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . 0.45 HG22 ' CD2' ' A' ' 21' ' ' TYR . 58.2 p -74.39 0.45 14.44 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.517 -1.22 . . . . 3.0 111.197 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 8.0 mm -80.41 74.88 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.434 0.635 . . . . 3.7400000000000002 110.911 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.639 ' HG3' ' H ' ' B' ' 13' ' ' SER . 12.0 tp10 -74.51 134.09 42.27 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.4 -0.818 . . . . 6.2199999999999998 109.875 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 18.4 m -72.26 -32.7 66.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.492 -0.322 . . . . 5.71 111.124 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 2.2 m -69.78 -36.7 75.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.138 0.494 . . . . 6.2300000000000004 110.64 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . 0.639 ' H ' ' HG3' ' B' ' 10' ' ' GLU . 5.1 m -141.31 101.67 4.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.82 -0.627 . . . . 5.9000000000000004 109.601 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ASP . . . . . . . . . . . . . 27.9 t70 . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.191 -0.458 . . . . 5.6200000000000001 110.943 -179.419 . . . . . . . . 0 0 . 1 stop_ save_